Vitas-M small molecule compound
{[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}(phenyl)acetic acid
Catalog ID
STL373172
SMILES COc1cc2CCC(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NC(c1ccccc1)C(=O)O)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 C29H30N2O7 MW 518.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O7/c1-16(32)30-21-12-10-18-14-24(36-2)27(37-3)28(38-4)25(18)19-11-13-22(23(33)15-20(19)21)31-26(29(34)35)17-8-6-5-7-9-17/h5-9,11,13-15,21,26H,10,12H2,1-4H3,(H,30,32)(H,31,33)(H,34,35)InChIKey
BQXLWJJFSVMLEN-UHFFFAOYSA-NSynonyms
1796891-35-4((7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)(phenyl)aceticacid
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)2phenylaceticacid
1796891354
2((7acetamido123trimethoxy9oxo67dihydro5Hbenzo(a)heptalen10yl)amino)2phenylaceticacid
CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NC(C4=CC=CC=C4)C(=O)O)OC)OC)OC
COc1cc2CC(C@@H)(c3c(c2c(c1OC)OC)ccc(c(=O)c3)N(C@@H)(c1ccccc1)C(=O)O)NC(=O)C
InChI=1SC29H30N2O7c116(32)30211210181424(362)27(373)28(384)25(18)19111322(23(33)1520(19)21)3126(29(34)35)178657917h591113152126H1012H214H3(H3032)(H3133)(H3435)
MFCD28143054
ZINC000096113680
ZINC000098063938
Check stock
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