Vitas-M small molecule compound

(7S)-N-{(2S)-1-[(3,4-dimethoxybenzyl)amino]-1-oxopropan-2-yl}-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide

Catalog ID
STL531455
SMILES COc1cc(CNC(=O)[C@@H](NC(=O)[C@@H]2Cc3c(C4N2C(=O)c2c4cccc2)[nH]c2c3cccc2)C)ccc1OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C31H30N4O5 MW 538.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O5/c1-17(29(36)32-16-18-12-13-25(39-2)26(14-18)40-3)33-30(37)24-15-22-19-8-6-7-11-23(19)34-27(22)28-20-9-4-5-10-21(20)31(38)35(24)28/h4-14,17,24,28,34H,15-16H2,1-3H3,(H,32,36)(H,33,37)/t17-,24-,28?/m0/s1
InChIKey
IELHDFYIBCSKNT-CBRZICSVSA-N
Synonyms
956997-46-9
(11~(S))~(N)((2~(S))1((34dimethoxyphenyl)methylamino)1oxopropan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((34dimethoxybenzyl)amino)1oxopropan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((34dimethoxybenzyl)amino)1oxopropan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405345
956997469
COc1cc(CNC(=O)(C@@H)(NC(=O)(C@@H)2Cc3c(C4N2C(=O)c2c4cccc2)(nH)c2c3cccc2)C)ccc1OC
InChI=1SC31H30N4O5c117(29(36)321618121325(392)26(1418)403)3330(37)241522198671123(19)3427(22)28209451021(20)31(38)35(24)28h41417242834H1516H213H3(H3236)(H3337)t172428?m0s1
MFCD06770145
ZINC000070704404
ZINC000070704407

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Available files

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