Vitas-M small molecule compound
4-(6,8-bis{[bis(2-methylpropyl)amino]methyl}-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)phenyl hexopyranoside
Catalog ID
STL035076
SMILES OCC1OC(Oc2ccc(cc2)c2coc3c(c2=O)c(O)c(c(c3CN(CC(C)C)CC(C)C)O)CN(CC(C)C)CC(C)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 C39H58N2O10 MW 714.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H58N2O10/c1-21(2)13-40(14-22(3)4)17-27-32(43)28(18-41(15-23(5)6)16-24(7)8)38-31(33(27)44)34(45)29(20-49-38)25-9-11-26(12-10-25)50-39-37(48)36(47)35(46)30(19-42)51-39/h9-12,20-24,30,35-37,39,42-44,46-48H,13-19H2,1-8H3InChIKey
ZIRVAXSEFMJJME-UHFFFAOYSA-NSynonyms
4(68bis((bis(2methylpropyl)amino)methyl)57dihydroxy4oxo4Hchromen3yl)phenylhexopyranoside
68bis((bis(2methylpropyl)amino)methyl)57dihydroxy3(4(345trihydroxy6(hydroxymethyl)oxan2yl)oxyphenyl)chromen4one
CC(C)CN(CC1=C(C2=C(C(=C1O)CN(CC(C)C)CC(C)C)OC=C(C2=O)C3=CC=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)O)CC(C)C
InChI=1SC39H58N2O10c121(2)1340(1422(3)4)172732(43)28(1841(1523(5)6)1624(7)8)3831(33(27)44)34(45)29(204938)2591126(121025)503937(48)36(47)35(46)30(1942)5139h91220243035373942444648H1319H218H3
MFCD18191977
ZINC000253531260
ZINC000253531261
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