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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-[1-(4-methoxyphenyl)-2-methylpropyl]-L-alaninamide

Catalog ID
STL546067
SMILES COc1ccc(cc1)C(C(C)C)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 C35H43N3O7 MW 617.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H43N3O7/c1-19(2)32(22-9-12-24(42-5)13-10-22)38-35(41)20(3)36-28-16-14-25-26(18-29(28)40)27(37-21(4)39)15-11-23-17-30(43-6)33(44-7)34(45-8)31(23)25/h9-10,12-14,16-20,27,32H,11,15H2,1-8H3,(H,36,40)(H,37,39)(H,38,41)/t20-,27-,32?/m0/s1
InChIKey
LBXMLJFWDOLDHD-RKTJMTASSA-N
Synonyms

(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(1(4methoxyphenyl)2methylpropyl)propanamide
(2S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1(4methoxyphenyl)2methylpropyl)propanamide
121541623
COc1ccc(cc1)C(C(C)C)NC(=O)(C@@H)(Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC35H43N3O7c119(2)32(2291224(425)131022)3835(41)20(3)362816142526(1829(28)40)27(3721(4)39)1511231730(436)33(447)34(458)31(23)25h910121416202732H1115H218H3(H3640)(H3739)(H3841)t202732?m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1(4methoxyphenyl)2methylpropyl)Lalaninamide
ZINC000263585652
ZINC000263585653

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Available files

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

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