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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-3-yl)ethyl]-L-valinamide

Catalog ID
STL542667
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)NCCc2c[nH]c3c2cccc3)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/c1-20(2)33(36(43)37-16-15-23-19-38-27-10-8-7-9-24(23)27)40-29-14-12-25-26(18-30(29)42)28(39-21(3)41)13-11-22-17-31(44-4)34(45-5)35(46-6)32(22)25/h7-10,12,14,17-20,28,33,38H,11,13,15-16H2,1-6H3,(H,37,43)(H,39,41)(H,40,42)/t28-,33-/m0/s1
InChIKey
ASWZVOIBNGPOPF-UVMMSNCQSA-N
Synonyms
1574354-64-5
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(1~(H)indol3yl)ethyl)3methylbutanamide
(S)N(2(1Hindol3yl)ethyl)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylbutanamide
1574354645
75492055
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)NCCc2c(nH)c3c2cccc3)C(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC36H42N4O6c120(2)33(36(43)371615231938271087924(23)27)402914122526(1830(29)42)28(3921(3)41)1311221731(444)34(455)35(466)32(22)25h71012141720283338H11131516H216H3(H3743)(H3941)(H4042)t2833m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(1Hindol3yl)ethyl)Lvalinamide
ZINC000108450195
ZINC108450195

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Available files

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