Vitas-M small molecule compound
methyl 2-[(3E)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK605666
SMILES COc1ccc(c(c1)C)/C(=C\1/C(c2ccc(c(c2)OC)O)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O
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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 C26H24N2O8S MW 524.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O8S/c1-12-10-15(34-3)7-8-16(12)21(30)19-20(14-6-9-17(29)18(11-14)35-4)28(24(32)22(19)31)26-27-13(2)23(37-26)25(33)36-5/h6-11,20,29-30H,1-5H3/b21-19+InChIKey
AKNRMFWZTKVXEM-XUTLUUPISA-NSynonyms
489464-99-5489464995
CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OC)C)C4=CC(=C(C=C4)O)OC)O
COc1ccc(c(c1)C)C(=C1C(c2ccc(c(c2)OC)O)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)O
InChI=1SC26H24N2O8Sc1121015(343)7816(12)21(30)1920(146917(29)18(1114)354)28(24(32)22(19)31)262713(2)23(3726)25(33)365h611202930H15H3b2119+
methyl2((3E)3(hydroxy(4methoxy2methylphenyl)methylidene)2(4hydroxy3methoxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2(3HYDROXY5(4HYDROXY3METHOXYPHENYL)4((4METHOXY2METHYLPHENYL)CARBONYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD08733291
ZINC000102699373
ZINC000102699380
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