Vitas-M small molecule compound
3-(6-hydroxy-1,3-benzodioxol-5-yl)-N-(4-hydroxytetrahydrothiophen-3-yl)-3-(4-oxo-4H-chromen-3-yl)propanamide
Catalog ID
STL549607
SMILES O=C(CC(c1coc2c(c1=O)cccc2)c1cc2OCOc2cc1O)NC1CSCC1O
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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 C23H21NO7S MW 455.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO7S/c25-17-7-21-20(30-11-31-21)5-14(17)13(6-22(27)24-16-9-32-10-18(16)26)15-8-29-19-4-2-1-3-12(19)23(15)28/h1-5,7-8,13,16,18,25-26H,6,9-11H2,(H,24,27)InChIKey
LOAZYIJBDDVONP-UHFFFAOYSA-NSynonyms
129895429
3(6hydroxy13benzodioxol5yl)~(N)(4hydroxythiolan3yl)3(4oxochromen3yl)propanamide
3(6hydroxy13benzodioxol5yl)N(4hydroxytetrahydrothiophen3yl)3(4oxo4Hchromen3yl)propanamide
3(6hydroxybenzo(d)(13)dioxol5yl)N(4hydroxytetrahydrothiophen3yl)3(4oxo4Hchromen3yl)propanamide
InChI=1SC23H21NO7Sc251772120(30113121)514(17)13(622(27)24169321018(16)26)1582919421312(19)23(15)28h15781316182526H6911H2(H2427)
MFCD31757090
ZINC000524731153
ZINC000524731156
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