Vitas-M small molecule compound

4-[3-(morpholin-4-yl)-3-oxo-1-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propyl]benzoic acid

Catalog ID
STL540361
SMILES O=C(N1CCOCC1)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1ccc(cc1)C(=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 C29H25NO9 MW 531.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO9/c31-20-15-21(17-4-2-1-3-5-17)39-28-23(25(33)27(35)26(34)24(20)28)19(14-22(32)30-10-12-38-13-11-30)16-6-8-18(9-7-16)29(36)37/h1-9,15,19,33-35H,10-14H2,(H,36,37)
InChIKey
JWRRCOMLFONYTK-UHFFFAOYSA-N
Synonyms
1630847-83-4
1630847834
4(3(morpholin4yl)3oxo1(567trihydroxy4oxo2phenyl4Hchromen8yl)propyl)benzoicacid
4(3morpholin4yl3oxo1(567trihydroxy4oxo2phenylchromen8yl)propyl)benzoicacid
4(3MORPHOLINO3OXO1(567TRIHYDROXY4OXO2PHENYL4HCHROMEN8YL)PROPYL)BENZOICACID
91637694
InChI=1SC29H25NO9c31201521(174213517)392823(25(33)27(35)26(34)24(20)28)19(1422(32)30101238131130)166818(9716)29(36)37h1915193335H1014H2(H3637)
MFCD28349533
ZINC000217786417
ZINC000217786518

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Available files

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