Vitas-M small molecule compound
methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-[4-(octyloxy)phenyl]propanoate
Catalog ID
STL543263
SMILES CCCCCCCCOc1ccc(cc1)C(c1c(=O)oc2c(c1O)cccc2)CC(=O)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 C27H32O6 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32O6/c1-3-4-5-6-7-10-17-32-20-15-13-19(14-16-20)22(18-24(28)31-2)25-26(29)21-11-8-9-12-23(21)33-27(25)30/h8-9,11-16,22,29H,3-7,10,17-18H2,1-2H3InChIKey
IDOKJKIBUMWXTN-UHFFFAOYSA-NSynonyms
1630852-52-61630852526
91636868
InChI=1SC27H32O6c13456710173220151319(141620)22(1824(28)312)2526(29)2111891223(21)3327(25)30h8911162229H37101718H212H3
methyl3(4hydroxy2oxo2Hchromen3yl)3(4(octyloxy)phenyl)propanoate
methyl3(4hydroxy2oxochromen3yl)3(4octoxyphenyl)propanoate
MFCD28348982
ZINC000217657165
ZINC000217657252
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