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