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N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(1H-indol-1-yl)ethyl]-L-valinamide

Catalog ID
STL541573
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)NCCn2ccc3c2cccc3)C(C)C)NC(=O)C)cc(c1OC)OC

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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 C36H42N4O6 MW 626.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H42N4O6/c1-21(2)33(36(43)37-16-18-40-17-15-23-9-7-8-10-29(23)40)39-28-14-12-25-26(20-30(28)42)27(38-22(3)41)13-11-24-19-31(44-4)34(45-5)35(46-6)32(24)25/h7-10,12,14-15,17,19-21,27,33H,11,13,16,18H2,1-6H3,(H,37,43)(H,38,41)(H,39,42)/t27-,33-/m0
InChIKey
UZDIDHXYMUOHEM-CMVGPNDKSA-N
Synonyms
1574347-45-7
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2indol1ylethyl)3methylbutanamide
(S)N(2(1Hindol1yl)ethyl)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylbutanamide
1574347457
75491787
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)NCCn2ccc3c2cccc3)C(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC36H42N4O6c121(2)33(36(43)371618401715239781029(23)40)392814122526(2030(28)42)27(3822(3)41)1311241931(444)34(455)35(466)32(24)25h7101214151719212733H11131618H216H3(H3743)(H3841)(H3942)t2733m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(1Hindol1yl)ethyl)Lvalinamide
ZINC000108449542
ZINC108449542

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Available files

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