Vitas-M small molecule compound

4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(6-methoxypyridin-3-yl)butanamide

Catalog ID
STL541779
SMILES COc1ccc(cn1)NC(=O)CCCNc1ccc2c(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 C31H36N4O7 MW 576.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4O7/c1-18(36)34-23-11-8-19-15-26(39-2)30(41-4)31(42-5)29(19)21-10-12-24(25(37)16-22(21)23)32-14-6-7-27(38)35-20-9-13-28(40-3)33-17-20/h9-10,12-13,15-17,23H,6-8,11,14H2,1-5H3,(H,32,37)(H,34,36)(H,35,38)/t23-/m0/s1
InChIKey
ZAEWKCIBMVVTAS-QHCPKHFHSA-N
Synonyms
1574344-88-9
(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(6methoxypyridin3yl)butanamide
1574344889
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(6methoxypyridin3yl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(6methoxypyridin3yl)butanamide
75491992
COc1ccc(cn1)NC(=O)CCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC31H36N4O7c118(36)3423118191526(392)30(414)31(425)29(19)21101224(25(37)1622(21)23)32146727(38)352091328(403)331720h9101213151723H681114H215H3(H3237)(H3436)(H3538)t23m0s1
ZINC000108450035
ZINC108450035

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Available files

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