Vitas-M small molecule compound
4-[({[4-(1,3-dioxo-5-phenyloctahydro-2H-4,7-methanoisoindol-2-yl)phenyl]carbonyl}oxy)acetyl]phenyl 3-methoxybenzoate
Catalog ID
STK290285
SMILES COc1cccc(c1)C(=O)Oc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C(C1)c1ccccc1
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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 C38H31NO8 MW 629.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H31NO8/c1-45-29-9-5-8-25(18-29)38(44)47-28-16-12-23(13-17-28)32(40)21-46-37(43)24-10-14-27(15-11-24)39-35(41)33-26-19-30(22-6-3-2-4-7-22)31(20-26)34(33)36(39)42/h2-18,26,30-31,33-34H,19-21H2,1H3InChIKey
BZZBMBXIQKFEHR-UHFFFAOYSA-NSynonyms
4((((4(13dioxo5phenyloctahydro2H47methanoisoindol2yl)phenyl)carbonyl)oxy)acetyl)phenyl3methoxybenzoate
COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)N4C(=O)C5C6CC(C5C4=O)C(C6)C7=CC=CC=C7
InChI=1SC38H31NO8c1452995825(1829)38(44)4728161223(131728)32(40)214637(43)24101427(151124)3935(41)33261930(226324722)31(2026)34(33)36(39)42h2182630313334H1921H21H3
MFCD06194532
ZINC000100397231
ZINC000239284768
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