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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-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-L-alaninamide

Catalog ID
STL550147
SMILES COc1cc2CCC(c2cc1OC)NC(=O)[C@@H](Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C

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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 C35H41N3O8 MW 631.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H41N3O8/c1-18(35(41)38-25-11-8-20-14-29(42-3)30(43-4)17-23(20)25)36-27-13-10-22-24(16-28(27)40)26(37-19(2)39)12-9-21-15-31(44-5)33(45-6)34(46-7)32(21)22/h10,13-18,25-26H,8-9,11-12H2,1-7H3,(H,36,40)(H,37,39)(H,38,41)/t18-,25?,26-/m0/s1
InChIKey
ZHVFPPJHSHBTJJ-XLXODUMSSA-N
Synonyms

(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(56dimethoxy23dihydro1~(H)inden1yl)propanamide
(2S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(56dimethoxy23dihydro1Hinden1yl)propanamide
129895532
COc1cc2CCC(c2cc1OC)NC(=O)(C@@H)(Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC35H41N3O8c118(35(41)3825118201429(423)30(434)1723(20)25)362713102224(1628(27)40)26(3719(2)39)129211531(445)33(456)34(467)32(21)22h1013182526H891112H217H3(H3640)(H3739)(H3841)t1825?26m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(56dimethoxy23dihydro1Hinden1yl)Lalaninamide
ZINC000524731470
ZINC000524731471

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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