| Phytochemical Name : Rescinnamine |
| PCNDIDR0010 |
| Pubchem CID : 5280954 |
| Molecular formula: C35H42N2O9 |
| Canonical SMILES : COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C=CC6=CC(=C(C(=C6)OC)OC)OC |
Synonymes : rescinnamine|Rescinnamin|24815-24-5|Cinnaloid|Rescisan|Resealoid|Scinnamina|Moderil|Cartric|Apoterin|Anaprel|Reserpinine|Cinnasil|Paresinan|Raurescin|Apolon|Rozex|Normorescina|Cinamine|Cinatabs|Raupyrol|Raurescine|Recinnamine|Recitensina|Rescaloid|Rescamin|Rescidan|Rescinpal|Rescitens|Reserpinene|Reskinnamin|Tenamine|Rescin|Resipal|Tuareg|Tsuruselpi S|Methyl trimethoxycinnamoylreserpate|Reserpinine (C35 alkaloid)|Reserpinine (VAN)|Rescinamina|Rescinnamina|Rescinnamine (VAN)|Rescinnaminum|Rescinnamina [DCIT]|Apoterin S|Rescinamina [INN-Spanish]|Rescinnaminum [INN-Latin]|Resepinine (C35 alkaloid)|Reserpinin|3,4,5-Trimethoxycinnamoyl methyl reserpate|Trimethoxycinnamoyl methyl reserpate|Rescinnamine [BAN:INN:JAN]|Trimethoxy cinnamoyl reserpate de methyl|CCRIS 4711|Tsuruselpi S (TN)|3,4,5-Trimethylcinnamoyl methyl reserpate|HSDB 2176|3,4,5-Trimethylcinnamic acid, ester with methyl reserpate|NSC15628|EINECS 246-471-8|Rescinnamine (JAN/INN)|NSC 15628|NSC-15628|3,4,5-Trimethoxycinnamic acid, methyl reserpate|Trimethoxy cinnamoyl reserpate de methyl [French]|UNII-Q6W1F7DJ2D|Methyl 18-O-(3,4,5-trimethoxycinnamoyl)reserpate|BRN 0075328|Q6W1F7DJ2D|Methyl reserpate 3,4,5-trimethoxycinnamic acid ester|AI3-52763|DTXSID3023554|CHEBI:28572|Rescinnamine [INN:BAN:JAN:NF]|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-|Anapral|11,17alpha-Dimethoxy-18beta-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-3beta,20alpha-yohimban-16beta-carboxylic acid methyl ester|3beta,20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), (E)-|4-25-00-01323 (Beilstein Handbook Reference)|methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate|Methyl 1alpha,2beta,3alpha,4,4aalpha,5,7,8,13,13bbeta,14,14aalpha-dodecahydro-2alpha,11-dimethoxy-3beta-(3,4,5-trimethoxycinnamoyloxy)benz(g)indolo(2,3-a)quinolizine-1beta-carboxylate|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)-oxy)-, methyl ester, (3beta,16beta,17alpha,18beta(E),20alpha)-|Reserpic acid methyl ester 3,4,5-trimethoxycinnamate|3,4,5-trimethoxycinnamic acid ester of methyl reserpate|O-(3,4,5-Trimethoxy-trans-cinnamoyl) methyl reserpate|Methyl 18beta-hydroxy-11,17alpha-dimethoxy-3beta,20alpha-yohimban-16beta-carboxylate|3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-11,17-alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester)|3beta,20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester)|NCGC00016787-01|Cinnasil (TN)|methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-({(2E)-3-[3,4,5-tris(methyloxy)phenyl]prop-2-enoyl}oxy)yohimban-16-carboxylate|Prestwick_558|Anaprel (TN)|Moderil (TN)|CAS-24815-24-5|Prestwick2_000568|Prestwick3_000568|RESCINNAMINE [MI]|RESCINNAMINE [INN]|RESCINNAMINE [JAN]|D0G8NJ|RESCINNAMINE [HSDB]|CHEMBL1668|RESCINNAMINE [VANDF]|BSPBio_000356|RESCINNAMINE [MART.]|MLS002153878|RESCINNAMINE [WHO-DD]|SCHEMBL181966|Rescinnamine [INN:BAN:JAN]|BPBio1_000392|GTPL7098|MEGxp0_001952|ACon1_002115|CHEBI:92923|DTXCID001079620|HMS1569B18|HMS2096B18|HMS2234E08|RESCINNAMINE [ORANGE BOOK]|3.beta.,20.alpha.-Yohimban-16.beta.-carboxylic acid, 18.beta.-hydroxy-11,17.alpha.-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester)|HY-A0220|Methyl 18.beta.-hydroxy-11,17.alpha.-dimethoxy-3.beta.,20.alpha.-yohimban-16.beta.-carboxylate|Tox21_110611|AKOS040744469|LS-1060|3,5-Trimethoxycinnamoyl methyl reserpate|NCGC00179585-03|NCGC00179585-04|SMR001233232|NP-011016|3,5-Trimethoxycinnamic acid, methyl reserpate|C06540|D00198|EN300-19731914|METHYL 3,4,5-TRIMETHOXYCINNAMOYL RESERPATE|Q409978|BRD-K52930707-001-02-2|BRD-K52930707-001-04-8|(3.BETA.,16.BETA.,17.ALPHA.,18.BETA.,20.ALPHA.)-11,17-DIMETHOXY-18-(((2E)-1-OXO-3-(3,4,5-TRIMETHOXYPHENYL)-2-PROPEN-1-YL)OXY)-YOHIMBAN-16-CARBOXYLIC ACID METHYL ESTER|11,17-Dimethoxy-18-[[1-oxo-3-3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-3,20-yohimban-16-carboxylic acid methyl ester|3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-11,17-alpha-dimethoxy-,methyl ester, 3,4,5-trimethoxycinnamate (ester)|3.beta., 18.beta.-hydroxy-11,17.alpha.-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester)|Benz[g]indolo[2, 1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydro-3-hydroxy-2,11-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate|methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-{[3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-3,13-diazapentacyclo[11.8.0.0^{2,10}.0^{4,9}.0^{15,20}]henicosa-2(10),4(9),5,7-tetraene-19-carboxylate|methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-{[3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-3,13-diazapentacyclo[11.8.0.0^{2,10}.0^{4,9}.0^{15,20}]henicosa-2(10),4,6,8-tetraene-19-carboxylate|methyl 11,17alpha-dimethoxy-18beta-{[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-3beta,20alpha-yohimban-16beta-carboxylate|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-(((2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)-|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3b,16b,17a,18b,20a)-|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-[[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)-|Yohimban-16-carboxylic acid,17-dimethoxy-18-[[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)-|Yohimban-16-carboxylicacid,11,17-dimethoxy-18-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]oxy]-,methyl ester, (3b,16b,17a,18b,20a)- |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 4.800 |
| Log Po/w (XLOGP3) : 4.470 |
| Log Po/w (WLOGP) : 3.760 |
| Log Po/w (MLOGP) : 1.780 |
| Log Po/w (SILICOS-IT) : 4.590 |
| Consensus Log Po/w : 3.880 |

