Vitas-M small molecule compound
methyl 3-[3-acetyl-2,6-dihydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)phenyl]-3-(1,3-benzodioxol-5-yl)propanoate
Catalog ID
STL548178
SMILES COC(=O)CC(c1c(O)c(cc(c1O)C(=O)C)C1OCc2c1c(O)c(nc2)C)c1ccc2c(c1)OCO2
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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 C27H25NO9 MW 507.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO9/c1-12-24(31)22-15(9-28-12)10-35-27(22)18-7-16(13(2)29)25(32)23(26(18)33)17(8-21(30)34-3)14-4-5-19-20(6-14)37-11-36-19/h4-7,9,17,27,31-33H,8,10-11H2,1-3H3InChIKey
LQWABSVEWLSZLI-UHFFFAOYSA-NSynonyms
122170158
InChI=1SC27H25NO9c11224(31)2215(92812)103527(22)18716(13(2)29)25(32)23(26(18)33)17(821(30)343)14451920(614)37113619h47917273133H81011H213H3
methyl3(3acetyl26dihydroxy5(7hydroxy6methyl13dihydrofuro(34c)pyridin1yl)phenyl)3(13benzodioxol5yl)propanoate
methyl3(3acetyl26dihydroxy5(7hydroxy6methyl13dihydrofuro(34c)pyridin1yl)phenyl)3(benzo(d)(13)dioxol5yl)propanoate
MFCD31756710
ZINC000409415485
ZINC000409415488
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