Vitas-M small molecule compound
dimethyl 3,3'-(2,5-dihydroxy-3,6-dioxocyclohexa-1,4-diene-1,4-diyl)bis[3-(4-methoxyphenyl)propanoate]
Catalog ID
STL544620
SMILES COC(=O)CC(C1=C(O)C(=O)C(=C(C1=O)O)C(c1ccc(cc1)OC)CC(=O)OC)c1ccc(cc1)OC
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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 C28H28O10 MW 524.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28O10/c1-35-17-9-5-15(6-10-17)19(13-21(29)37-3)23-25(31)27(33)24(28(34)26(23)32)20(14-22(30)38-4)16-7-11-18(36-2)12-8-16/h5-12,19-20,31,34H,13-14H2,1-4H3InChIKey
BMPJIMAACJORLP-UHFFFAOYSA-NSynonyms
1676079-25-6102564496
1676079256
dimethyl33(25dihydroxy36dioxocyclohexa14diene14diyl)bis(3(4methoxyphenyl)propanoate)
InChI=1SC28H28O10c135179515(61017)19(1321(29)373)2325(31)27(33)24(28(34)26(23)32)20(1422(30)384)1671118(362)12816h51219203134H1314H214H3
methyl3(25dihydroxy4(3methoxy1(4methoxyphenyl)3oxopropyl)36dioxocyclohexa14dien1yl)3(4methoxyphenyl)propanoate
MFCD28985391
ZINC000217952325
ZINC000217952478
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