4DY

(6E)-N-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide

Created:	2015-04-30
Last modified:	2020-05-26

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7 entries where 4DY is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	49
Chiral Atom Count	0
Bond Count	49
Aromatic Bond Count	6

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Chemical Component Summary
Name	(6E)-N-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide
Synonyms	Capsaicin; 8-Methyl-N-vanillyl-trans-6-nonenamide; NGX-4010
Systematic Name (OpenEye OEToolkits)	(E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-8-methyl-non-6-enamide
Formula	C₁₈ H₂₇ N O₃
Molecular Weight	305.412
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1(CNC(CCCC[C@H]=CC(C)C)=O)cc(OC)c(cc1)O
SMILES	CACTVS	3.385	COc1cc(CNC(=O)CCCCC=CC(C)C)ccc1O
SMILES	OpenEye OEToolkits	1.7.6	CC(C)C=CCCCCC(=O)NCc1ccc(c(c1)OC)O
Canonical SMILES	CACTVS	3.385	COc1cc(CNC(=O)CCCC/C=C/C(C)C)ccc1O
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC(C)/C=C/CCCCC(=O)NCc1ccc(c(c1)OC)O
InChI	InChI	1.03	InChI=1S/C18H27NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h6,8,10-12,14,20H,4-5,7,9,13H2,1-3H3,(H,19,21)/b8-6+
InChIKey	InChI	1.03	YKPUWZUDDOIDPM-SOFGYWHQSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License

DrugBank ID	DB06774 ?
Name	Capsaicin
Groups	approved
Description	Capsaicin is most often used as a topical analgesic and exists in many formulations of cream, liquid, and patch preparations of various strengths; however, it may also be found in some dietary supplements. Capsaicin is a naturally-occurring botanical irritant in chili peppers, synthetically derived for pharmaceutical formulations. The most recent capsaicin FDA approval was Qutenza, an 8% capsaicin patch dermal-delivery system, indicated for neuropathic pain associated with post-herpetic neuralgia.
Synonyms	trans-8-Methyl-N-vanillyl-6-nonenamide Isodecenoic acid vanillylamide Capsaicina (E)-8-Methyl-N-vanillyl-6-nonenamide Capsaicin
Brand Names	Relyyt Nufabrx Compression Sock Dusel Warm Arthritis Dead Sea Salt Therapy Minted Leaf Heat Therapy Relief Roll-On AmeriPatch Pain Relief Hot Patch Guardania Pain Menthol, Capsaicin Solaice Neuriterx Earths Care Arthritis Miracle Plus Overnight Pain Relieving Miracle Plus Neck and Shoulder Pain Relief Revlex Arthritis Pain Relief Capzasin P Arthritis Pain Relief Pain Relief Patch Kessler Family Wellness Capsaicin Heat Patches Back and Large Areas CVS Capsaicin Arthritazin Pain Relieving Equi-block Dt Formula Red Hot Zostrix Joint and Arthritis Pain Relief Zostrix Original Strength Family Care Thera Flex Pain NuDroxiPAK E-400 Coralite Medicated Heat Arthmed Topical Analgesic Extra Strength Pain Reliever Kool Heat Pain Therapy Capzasin HP Arthritis Pain Relief Nufabrx Lower Leg Sleeve M/L Silvera Pain Relief Patch Anodynz Biofrequency Chip Alivio Menthozen Hydrogel Patch Pain Relieving Gel-Patch Nufabrx Calf Sleeve Ziks Arthritis Pain Relief Transderm-IQ Aspercreme Warming NuDroxiPAK DSDR-50 Renovo PainKoolers Topical Analgesic Invisible Pain Megrix PainKoolers Topical Analgesic Patch Limencin Parche Leon Menthozen Nufabrx Ankle Sock Renovo Lido5 Sure Result SR Relief Flanax Liniment Capsodan Cream CVS Medicated Heat 1 ct Kapzin DC Medi-sulting Topical Pain Relief Megrix OTC Muscular Balm Ageranium Patch Better Nature Pain Relief BalmX Capsiderm Capsaicin 0.075 Percent SmartRx Gaba-V Kit Soothee Patch beeRX Muscle and Joint Pain Relief Menthol 4.5% Capsaicin 0.0225% CMX Topical Pain Menthozen Cream Chill Pain Away Adazin BIO-MEGA Heat Therapy CapsFenac Pak RETADOLOR Pain Relief Neuriterx 0.05% Apanol Linimento Obrero Rugby Arthritis Pain Relieving Topical Analgesic RockSauce FIERY HOT PAIN RELIEF Antiphlogistine Rub A-535 Capsaicin Liquid Nufabrx Diabetic Sock Pain Relief Fast Arthritis Aid Pain Relieving Oprava Capsaicin Hot Patches Zostrix Diabetic Joint and Arthritis Pain Relief MaC Patch Kapsin External Analgesic Arthricare for Women Quick Drying Nufabrx Neck Wrap Coralite Pain Relief bB Medicated Pain Relieving Oil Jupiter Pain Patch Rugby Capsaicin External Analgesic Simanix Rematex Exoten-C FourPainRX NuDroxiPAK DSDR-75 Capment Capsaicin HP Arthritis Pain Relief Heet Liniment Liq Doloracin Rx LexiCaps LABOFLEX Cool and Hot Menthol 1.25 percent Capsaicin 0.025 percent BioMega Heat Pain Therapy Perform Atomic Heat Capsaicin Parche Leon Milagroso Allevess Flexin Pallerix OTC BIOfrequency Chip Theragen LaBella Linimento Obrero Douleurin Topical Pain Relief Power Pain Relief Stick Pure Pain Relief Capsaicin Topical Analgesic Capsaicin 0.1 Percent Penetrex(r) Arthritis Pain Relief Dolor-parche With Lidocaine-RX Capsaicin Mild Cream Dr.'s Cream Australian Dream Power 4 Muscle and Joint Pain Relief Cream Menthocin Patch with Lidocaine - Strong Zostrix Hot and Cold Therapy System Capsaicin External Analgesic Capsaicin Cream 0.025% WellPatch Capsaicin Pain Relief Screamin Hot Toast DicloHeal-60 Glacierix Nufabrx Arm Sleeve Sinelee BRONSON SOOTHE Pain Relief Neuvaxin Patch CyclobenzaprinePax True Pain Relief Plus Capsaicin Arthritis Pain Relief Cream Mentholatum Ironman 1st Medxpatch With Lidocaine 4% Blue Ice Pain Relieving SprayPain Away External Analgesic Zostrix Foot Pain Relief Frankie Avalons Zero Pain Roll On Capxib Joint Maintenance Compliance Kit Paraid Hot Capsicum FlexePax Outdoor Hands Overtime-X Capsaicin No-Fuss Applicator Toplast Cool and Hot Menthol 5percent plus Capsaicin 0.025percent Leader Capsaicin Nufabrx Back Wrap PainMD Max My Omega Heat Therapy Pain Away Hot Pain Relieving Capsaicin Cream Offense Player Sports NuDroxiPAK Capzasin No Mess Applicator Capsaicin Pain Relief LidoPro DICLAREAL TOPICAL kit PureKana Sure Result DSS Premium Pak Ziclopro AthletesGel Pain Relief Cream Extra Strength Reliever Rite Aid Capsicum Hot Capzasin-P Creme - 0.025% Flex-OL Wasabi Rub Assured Pain Relief Hot Patch Dr Demand Relief Pain Relief Coralite Topical Analgesic Capsaicin Heat Walgreens Capsaicin Hot Pure Relief Penetrating Pain Relief Rock Sauce Nufabrx Medicine Infused Ankle Sleeve Trans-D Neurodexx Zostrix High Potency Foot Pain Relief Triple Action Arthritis 2-Count HEAT PATCHES Coralite Pain Relief Hot Reliaderm Kanjo Natural Pain relief oil Flanax Liniment Unit Dose Display Rezil Medi-patch With Lidocaine Rx Hong Hoa Pain Relieving Coralite Muscle and Joint Pain Relief Arthricare for Women Multi-action Capsinac Therapatch Warm Bio-Sorb Nufabrx Knee Sleeve Pennsaicin Med O-3 Bio- Transanosil K2c Arthritis Pain Relief BioMega Ameri Patch Raging Kakapo Pain Relieve Zostrix Foot Pain Relief Maximum Strength PainBloc24 Nufabrx Ankle Sleeve NuDiclo TabPak Moor Balm - Crm Dr Iyers MyoRub Dr. OH BALM NuDroxiPAK N-500 Inavix Capsicum Patch Alegenix Biofrequency Chip Trubrexa Patch ER Arthritis Extra Strength Roll-ON Lotion HURT BLOCKER PRO Pain Relief Nufabrx Medicine Infused Socks PainBloc NuDroxicin pain relief Roll-On Overtime-HMP Good Neighbor Pharmacy Arthritis Pain Relief Preferred Plus Arthritis Cream Rocksauce Fire Mac Nuvira Patch Zostrix Hp Reme D CMC Pain Relieving DINGTAI PHARMATopical Analgesic NobleAid CapsAid Medrox Toplast Cool and Hot Menthol 4percent plus Capsaicin 0.025percent Aleveer Patch Fatazen Sweat Enhance Hot Synovium Pain Relieving Gel Kapsin Walgreens Arthritis Pain Relief Capsaicin Analgesic Gellert Joint Care Hot spot point relief Diclopak Sinsinpas Hot Equate Capsaicin Pain Relieving Toplast Cool and Hot Menthol 1.25percent plus Capsaicin 0.025percent Complete hemp Family Care Arthritis Pain Relief Menthacin - Cream Aspercreme Warming Patch ZENSEZONE Arthmed Temporary Pain Relief Cream Flanax Diclosiacin Terocin Ziclocin AnodyneRx CareALL Arthritis and Muscle Capzix Moisturizing Glucosamine Brand Wellness Products VictoRx Tianhe Zhuifeng Gao Xoten-C KASEHA Pain Relieving Gel Doloracin/l Rx With Lidocaine Mendex Castiva Warming Migryl Anodynz IRxAmigra Aspercreme Warming No Mess Medi-patch With Lidocaine Satogesic Hot Qutenza Pain Relieving Medicated Pain Relief Hot NaproxenPax Satohap Cool and Hot Pads Diclovix CM MedWorx Born Again Super Pain Relieving Lotion Genorthix Pain Relieving Roll On Capsimide Alivio Medicated Pain Benejoint Soothanol X2 FlexxSonic Pain Relief Atomic Balm Astrapharm Chilli Brand Arthritic Pain Relief Medrox-Rx Arthritis Pain Reliever Lidopro Migryl Biofrequency Chip NuDroxicin Captracin NuDroxiPAK M-15 FYZICAL SPORTS Pain Relief 2 MILD Arth RX Topical Analgesic Ultra Strength Pain Relief Littles All Natural Arthritic Pain Relief Nexalgia CVS Capsaicin arthritis pain relief DFS 75mg DR/MS 25%/MENTH 6%/CAP 0.025% PAK Awaye EMU THERAPY Red Hot Pepper Pain Relief Cream Neuritrx Red hot Trubrexa Menthocin Patch with Lidocaine Medicated Heat Offense Player Arthritis Pain Rotex Nufabrx Lower Leg Sleeve DCH Arthritis Pain Relief Roll-On Terphouse IRxMyoRub Parche Leon Milagroso Dual Action 1st Medxpatch With Lidocaine 4%-rx Sherman and Clark Pain Relieving Dfs 1.5%/ms 25%/menth 6%/cap 0.025% Pak Cannavera Pain Relief LCDO. ORLANDO RIVERA ARTHRITIS Topical Analgesic Fors Pain Relief FYZICAL SPORTS Pain Relief 1-COOL AVON HeXashield Arthritis Pain Relief Cream Capsaisin Medi-derm Topical Pain Relief Tianhe Gutong Tiegao VitaCin CopperFixx Pallerix Medi-derm Rx Cajun Hot Ice Muscle and Joint Pain Rub Flexipak Bioaches Menthacin Lotion Astrapharm Chilli Brand External Medicated Better Nature Pain Relief Cream LivRelief Pain Relief Dr. Harveys Herbal Motion Pain Formula N-LABS SOLAR MAX Topical Analgesic Omega 3 Iclofenac CP Cvs Capsaicin Ultimate Topical Pain Relief Patch Sinsinpas Hot Large Kentwool SensationWool with Nufabrx BLUE SPRING Foot and Leg Comfort Cream with Pain Relief Theragen HP Corisin Arthritis Pain Relief Yunnan Baiyao Arthritis Pain Relief Lido-RX 4.1 Omega 3 Heat Therapy Frankie Avalons ZERO PAIN Original Formula Roll-On Maximum Strength PAIN RELIEVER FYZICAL SPORTS Pain Relief Capsaicin Forte Cream Good Neighbor Capsaicin Heat Patch for Back Arthritazin Pain Relieving EZ Menthozen Hydrogel Painazin CP Overtime-hmp NuDiclo SoluPak Nufabrx Hand/Wrist Sleeve Qroxin Patch Arth Arrest Rub A535 Capsaicin Soothe Compression Sock Rocksauce Ice New Terocin Remaxazon External Patch Dyninex VANTELIN HOT PAIN RELIEVING Gel Patch Large Wellness Products J-FLEX Pain Relief Roll On Kerasal NeuroCream Diclosaicin Nopiate Topical Pain Relief SumaChip Topical Pain Relief Rx VANTELIN HOT PAIN RELIEVING Gel Patch CareOne Arthritis Pain Relief Nufabrx Wrist Sleeve Campo pharma Muscle hot Ultracin Melt Pain Away Capsaicin Heat Overtime LONOL Forte Gel NaproPax Arthricare for Women Extra Moisturizing Eagle Emu Essentials Brand Pain Relieving Diclofex DC Mega Patch Toplast Hot Capsaicin 0.025percent Ultra Therapy Pain Relief CVS Roll-On InstaSoothe Pain Relief QC Arthritis Pain Relief Assured Pain Relief Hot Menthol Medi-derm / L With Lidocaine Xyphex Biofrequency Chip NuDroxiPAK I-800 MenCaps A2a Arthritis MediRelief Hot Good Neighbor Pharmacy Capsaicin MINTED LEAF Heat Therapy Relief Roll On Capsaicin Regular Cream Nuvira CANNABIN PLUS Warming Pain Relief Aflexeryl-MC Hot Pain Relief Solstice Capsaicin Patch Hot Nufabrx Lower Leg Sleeve XS/S WellPatch Warming Pain Relief PainKoolers Weh-Weh Natural Pain relief oil Transderm-iQ Hempvana Ultra Strength Pain Relief Cream - Deep Heat Hurt Blocker Pro Arthur Itis Cream Releevia MC Nufabrx Grey Polka Dot Sock Medicated Compression Sock Capzasin Quick Relief Levatio Patch Pure Relief Nufabrx Foot/Ankle Sleeve Fesi MINTED LEAF Heat Therapy Roll-On with Capsaicin and CBD Rugby Capsaicin Cream Astronic Dendracin Neurodendraxcin Meijer Capsaicin Therapy Pain Capsaicin Heat Patches Pain Relief Releevia Zang Hong Hua Pain Relieving Medi-derm / L With Lidocaine Rx Nufabrx Lower Leg Sleeve XL/XXL Leader Capsaicin Pain Relief Cream Pain Relieving Roll-On Topical Pain Relief LaboFlex Cool and Hot Menthol 1.25 percent Capsaicin 0.025 percent Sure Relief SR Relief Tianhe Gutong Tiegao (in Polyisobutylene Carrier) Antiphlogistine Rub A-535 Capsaicin Gel LBri Super Aloe Stop The Pain Hot Spot Point Relief
Indication	The capsaicin 8% patch is indicated in the treatment of neuropathic pain associated with post-herpetic neuralgia. There are multiple topical capsaicin formulations available, including creams and solutions, indicated for temporary analgesia in muscle and join pain as well as neuropathic pain.
Categories	Alkaloids Alkenes Amides Analgesics Anesthetics Anesthetics, Local Antipruritics Basic Lotions and Liniments Benzene Derivatives Capsaicin and Similar Agents Cholinesterase Inhibitors Cytochrome P-450 CYP1A2 Inducers Cytochrome P-450 CYP1A2 Inducers (strength unknown) Cytochrome P-450 CYP1A2 Substrates Cytochrome P-450 CYP2E1 Substrates Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (strength unknown) Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Enzyme Inhibitors Cytochrome P-450 Substrates Dermatologicals Lipids Monoamine Oxidase A Inhibitors for interaction with Monoamine Oxidase A substrates Peripheral Nervous System Agents Phenols Polyunsaturated Alkamides Sensory System Agents Solanaceous Alkaloids Topical Products for Joint and Muscular Pain TRPV1 Channel Agonists
ATC-Code	M02AB01 N01BX04
CAS number	404-86-4

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License

Name	Target Sequence	Pharmacological Action	Actions
Transient receptor potential cation channel subfamily V member 1	MKKWSSTDLGAAADPLQKDTCPDPLDGDPNSRPPPAKPQLSTAKSRTRLF...	unknown	agonist,regulator
Prohibitin-2	MAQNLKDLAGRLPAGPRGMGTALKLLLGAGAVAYGVRESVFTVEGGHRAI...	unknown
Cytochrome P450 3A4	MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNI...	unknown	inhibitor
Prostaglandin G/H synthase 2	MLARALLLCAVLALSHTANPCCSHPCQNRGVCMSVGFDQYKCDCTRTGFY...	unknown	inhibitor
Myeloperoxidase	MGVPFFSSLRCMVDLGPCWAGGLTAEMKLLLALAGLLAILATPQPSEGAA...	unknown	inhibitor
Cytochrome P450 1A2	MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPL...	unknown	substrate,inducer
Cytochrome P450 2E1	MSALGVTVALLVWAAFLLLVSMWRQVHSSWNLPPGPFPLPIIGNLFQLEL...	unknown	substrate
Amine oxidase [flavin-containing] A	MENQEKASIAGHMFDVVVIGGGISGLSAAKLLTEYGVSVLVLEARDRVGG...	unknown	inhibitor
Dopamine beta-hydroxylase	MPALSRWASLPGPSMREAAFMYSTAVAIFLVILVAALQGSAPRESPLPYH...	unknown	inhibitor
Glutamine synthetase	MTTSASSHLNKGIKQVYMSLPQGEKVQAMYIWIDGTGEGLRCKTRTLDSE...	unknown	inducer
Cholinesterase	MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFG...	unknown	inhibitor
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Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682