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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-(7-methoxyquinolin-3-yl)-L-valinamide

Catalog ID
STL541364
SMILES COc1ccc2c(c1)ncc(c2)NC(=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 C36H40N4O7 MW 640.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H40N4O7/c1-19(2)33(36(43)39-23-14-21-8-10-24(44-4)16-29(21)37-18-23)40-28-13-11-25-26(17-30(28)42)27(38-20(3)41)12-9-22-15-31(45-5)34(46-6)35(47-7)32(22)25/h8,10-11,13-19,27,33H,9,12H2,1-7H3,(H,38,41)(H,39,43)(H,40,42)/t27-,33-/m0/s1
InChIKey
VBRZGQSCOSPDNC-CMVGPNDKSA-N
Synonyms
1574344-23-2
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(7methoxyquinolin3yl)3methylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(7methoxyquinolin3yl)3methylbutanamide
1574344232
75492391
COc1ccc2c(c1)ncc(c2)NC(=O)(C@H)(C(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC36H40N4O7c119(2)33(36(43)3923142181024(444)1629(21)371823)402813112526(1730(28)42)27(3820(3)41)129221531(455)34(466)35(477)32(22)25h8101113192733H912H217H3(H3841)(H3943)(H4042)t2733m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(7methoxyquinolin3yl)Lvalinamide
ZINC000150653785
ZINC150653785

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Available files

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