WHC is still in active development. Read this to understand our approach.
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isomerdesign

Capsaicin

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pubchem

Capsaicin

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drugmap

Capsaicin

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drugmap

Capsaicin

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Data

InChI: 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)

Synonyms: NCGC00090853-08,NCGC00090853-02,CAPSAICIN [INCI],SBI-0052593.P002,NSC-757844,ZOSTRIX (TN),7553-53-9,(6E)-N-{[4-hydroxy-3-(methyloxy)phenyl]methyl}-8-methylnon-6-enamide,TNP00277,HMS2092D21,Tox21_200315,CAPSAICIN, NATURAL,Methyl-N-vanillyl-6-noneneamide,6-Nonenamide, 8-methyl-N-vanillyl-, (E)-,(e)-n-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide,NCGC00017337-07,SCHEMBL8086,4DY,SCHEMBL8085,NCGC00090853-01,E-CAPSAICIN,NCGC00090853-03,SR-05000001861-5,Capsaicin, Pharmaceutical Secondary Standard; Certified Reference Material,DB06774,MFCD00017259,AB00053098-11,NCGC00017337-04,Capsaicin (transdermal patch formulation, neuropathic pain),Capsaicin [in oleoresin of capsicum],HMS501B16,N-[(4-Hydroxy-3-methoxyphenyl)methyl]-8-methyl-6-nonenamide,CAPSAICIN (CONSTITUENT OF CAPSICUM) [DSC],Zostrix HP,neurotoxic,S07O44R1ZM,NSC_2548,CAPSAICIN [USP MONOGRAPH],HMS2089N11,BBL027836,EI-125,HMS1989N10,Pharmakon1600-01501128,Cntx-4975,depletes Substance P,Qutenza,trans-8-Methyl-N-vanillyl-6-nonenamide,Capzasin-hp,CHEMBL294199,DSSTox_RID_75455,isoamyl4-methoxycinnamate,SMP2_000337,CNTX-4975,CAS_404-86-4,Caswell No. 158,UPCMLD-DP092,Isodecenoic acid vanillylamide,(6E)-N-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide,DSSTox_GSID_20241,epsilon-capsaicin,Qutenza;Vanilloid,UPCMLD-DP092:002,Mioton,NSC-56353,CHEBI:94524,CAPSAICIN [VANDF],MLS002154049,CAPSAICINE,HMS1361N10,NCGC00017337-08,N-(4-HYDROXY-3-METHOXYBENZYL)-8-METHYL-6-NONENAMIDE [FHFI],Adlea,8-Methyl-N-vanillyl-6-nonenamide,NSC757844,trans-Capsaicin-d3,NCGC00017337-03,6-Nonenamide, N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methyl-, (6E)-,8-Methyl-N-Vanillyl-6-Nonenamide,NCGC00017337-17,Capsaicin, United States Pharmacopeia (USP) Reference Standard,Capsaicin, European Pharmacopoeia (EP) Reference Standard,(E)-8-Methyl-N-vanillyl-6-nonenamide,HMS3678F11,DSSTox_CID_241,Capsaicin (8-Methyl-N-vanillyl-6-nonenamide),CAPSAICIN [USP-RS],6-nonenamide,n-((4-hydroxy-3-methoxyphenyl)methyl)-8-methyl-,(6e)-,Capsaicin (Natural),NCGC00090853-11,N-(3-Methoxy-4-hydroxybenzyl)-8-methyl-6-nonenamide,Isodecenoate,Zostrix,Capsaicinoid,Ovocap,SR-05000001861-1,(E)-Capsaicin,CHEBI:3374,CAPSAICIN [WHO-DD],HY-10448A,MR3H3,BSPBio_000957,NCGC00017337-12,Q273169,NGX-3781,Axsain,starbld0019180,EN300-7544118,NCGC00017337-10,NCGC00017337-06,Capsicine,HMS1791N10,CAPSAICINOIDS,ALGRX-4975,HMS1570P19,CCRIS 1588,NCGC00017337-09,NSC 56353,TQ-1018,Capsaicin,(S),BRD-K37056290-001-01-1,HMS3649N15,SDCCGMLS-0066678.P001,NGX-7325,CAPSAICIN [JAN],Capsaicin [USAN],FEMA No. 3404,(E)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-8-methyl-non-6-enamide,Bitter orange extract 30%,N-((4-Hydroxy-3-methoxyphenyl)methyl)-8-methyl-6-nonenamide,CAPSAICIN [EMA EPAR],8-Methyl-N-vanillyl-6-nonenamide, (E)-,C06866,IDI1_000354,6-Nonenamide, N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methyl-, (E)-,Prestwick_204,Citrus Aurantium 30%,CAPSAICIN [ORANGE BOOK],D00250,HMS3414F11,KS-5181,CAPSAICIN [HSDB],Citrus Aurantium Extract,BPBio1_001053,AB00053098_12,trans-N-((4-Hydroxy-3-methoxyphenyl)methyl)-8-methyl-6-nonenamide,CAPSAICIN [INN],Capsaicin, >=95%, from Capsicum sp.,CCG-39908,ZINC1530575,HY-10448,(6E)-N-(4-Hydroxy-3-methoxybenzyl)-8-methyl-6-nonenamide #,(E)-N-[(4-Hydroxy-3-methoxyphenyl)-methyl]-8-methyl-6-nonenamide,6-Nonenamide, (E)-,HMS2230O23,LS-14673,CAPSAICIN [MART.],BSPBio_001548,EPA Pesticide Chemical Code 070701,UPCMLD-DP092:001,Capsaicin; 8-Methyl-N-vanillyl-trans-6-nonenamide; NGX-4010,IDI1_034018,CS-0181240,Prestwick2_000879,Capsaicin [USP:INN],Capsaicin, analytical standard,BDBM20461,(6E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide,8-Methyl-N-vanillyl-6E-nonenamide,C-1700,Ratden pe 40,NCI-C56564,Capsaicin (in oleoresin of capsicum),GTPL2486,HMS1921H11,NCGC00017337-11,NCGC00017337-18,BRN 2816484,Prestwick3_000879,8-Methyl-N-vanillyl-(trans)-6-nonenamide,trans-Capsaicin,Capsaicin, certified reference material, TraceCERT(R),N1667,Capsaicin (JAN/USP),NCGC00017337-05,6-Nonenamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methyl-, (6E)-,Capsaicin 10 microg/mL in Acetonitrile,Ausanil,NCGC00090853-04,NGX-4010,N-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide,Capsaicin,AKOS007930159,CAS-404-86-4,Togarashi orenji,N0C781,N-(4-Hydroxy-3-methoxybenzyl)-8-methylnon-trans-6-enamide,NCGC00090853-10,BRD-K50590187-001-06-6,HSDB 954,404-86-4,Dolenon,NCGC00017337-13,NGX 4010,(E)-8-Methyl-N-vanillyl-6-nonenamide(8cl),LMFA08020085,Capsaicin, from Capsicum sp., >=50% (HPLC),NCGC00090853-07,SPECTRUM1501128,UNII-S07O44R1ZM,SR-05000001861-4,N-[(4-hydroxy-3-methoxyphenyl)methyl]-6E-8-methyl-nonenamide,NCGC00090853-12,NCGC00257869-01,SR-05000001861,SMR000718774,BDBM86537,Transacin,NSC56353,(E)8-methyl-N-vanillyl-6-Nonenamide,SR-05000001861-6,CAPSAICIN [MI],HMS3402N10,CS-1518,6-Nonenamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methyl-, (E)-,EINECS 206-969-8,NGX-1998,1217899-52-9,DTXSID9020241,M1149,NCGC00017337-02,AMY25669,capsacin(E),6-Nonenamide, (E)-N-((4-hydroxy-3-methoxy-phenyl)methyl)-8-methyl,(E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide,Styptysat,N-((4-Hydroxy-3-methoxyphenyl)methyl)-8-methyl-6-nonenamide, (E)-,8-Methyl-N-vanillyl-trans-6-nonenamide,SR-05000001861-9,Tox21_110817,CCG-39657,BSPBio_002917,AC-10114,NCGC00090853-06,s1990,ALGRX 4975,NCGC00090853-09,(E)-N-((4-Hydroxy-3-methoxyphenyl)-methyl)-8-methyl-6-nonenamide,(E)-N-[(4-HYDROXY-3-METHOXYPHENYL)METHYL]-8-METHYL-6-NONENAMIDE,HMS2097P19,Spectrum5_000538,CITRUS AURANTIUM PE,MEGxp0_001448,Vanilloid,STL372889


Estimated data

Solubility: -4.182 (log(S) in mol/L prediction using SolTranNet)

Blood Brain Barrier Permeability: Yes (prediction using frontiersin.org)

Addictivity Prediction: 54.0% (prediction based on www.mdpi.com)

Similarities

The following is a set of comparisons to understand the properties of this compound. This is still higly experimental and is still under active development. Please refer to our series of blog posts to fully understand our approach and its limitations. This information is for informational purposes only and should not be construed as medical advice.