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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-(3,4-dimethoxybenzyl)-L-valinamide

Catalog ID
STL540287
SMILES COc1ccc(cc1OC)CNC(=O)[C@H](C(C)C)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C35H43N3O8 MW 633.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H43N3O8/c1-19(2)32(35(41)36-18-21-9-14-28(42-4)29(15-21)43-5)38-26-13-11-23-24(17-27(26)40)25(37-20(3)39)12-10-22-16-30(44-6)33(45-7)34(46-8)31(22)23/h9,11,13-17,19,25,32H,10,12,18H2,1-8H3,(H,36,41)(H,37,39)(H,38,40)/t25-,32-/m0/s1
InChIKey
PNTZWKZIHXKCME-UKJJDJLKSA-N
Synonyms
1574351-39-5
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((34dimethoxyphenyl)methyl)3methylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(34dimethoxybenzyl)3methylbutanamide
1574351395
75492243
COc1ccc(cc1OC)CNC(=O)(C@H)(C(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC35H43N3O8c119(2)32(35(41)36182191428(424)29(1521)435)382613112324(1727(26)40)25(3720(3)39)1210221630(446)33(457)34(468)31(22)23h9111317192532H101218H218H3(H3641)(H3739)(H3840)t2532m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(34dimethoxybenzyl)Lvalinamide
ZINC000108450610
ZINC108450610

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Available files

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