Vitas-M small molecule compound
4-{5,7-dihydroxy-6,8-bis[(3-methylpiperidin-1-yl)methyl]-4-oxo-4H-chromen-3-yl}phenyl hexopyranoside
Catalog ID
STL035077
SMILES OCC1OC(Oc2ccc(cc2)c2coc3c(c2=O)c(O)c(c(c3CN2CCCC(C2)C)O)CN2CCCC(C2)C)C(C(C1O)O)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 C35H46N2O10 MW 654.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H46N2O10/c1-19-5-3-11-36(13-19)15-23-28(39)24(16-37-12-4-6-20(2)14-37)34-27(29(23)40)30(41)25(18-45-34)21-7-9-22(10-8-21)46-35-33(44)32(43)31(42)26(17-38)47-35/h7-10,18-20,26,31-33,35,38-40,42-44H,3-6,11-17H2,1-2H3InChIKey
JWVPRIUMDUETIT-UHFFFAOYSA-NSynonyms
4(57dihydroxy68bis((3methylpiperidin1yl)methyl)4oxo4Hchromen3yl)phenylhexopyranoside
57dihydroxy68bis((3methylpiperidin1yl)methyl)3(4(345trihydroxy6(hydroxymethyl)oxan2yl)oxyphenyl)chromen4one
CC1CCCN(C1)CC2=C(C3=C(C(=C2O)CN4CCCC(C4)C)OC=C(C3=O)C5=CC=C(C=C5)OC6C(C(C(C(O6)CO)O)O)O)O
InChI=1SC35H46N2O10c119531136(1319)152328(39)24(1637124620(2)1437)3427(29(23)40)30(41)25(184534)217922(10821)463533(44)32(43)31(42)26(1738)4735h71018202631333538404244H361117H212H3
MFCD18191978
ZINC000253531250
ZINC000253531253
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