Vitas-M small molecule compound
2-acetylnaphthalen-1-yl 4-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate
Catalog ID
STK387190
SMILES O=C1N(c2ccc(cc2)C(=O)Oc2c(ccc3c2cccc3)C(=O)C)C(=O)C2C1C1C=CC2C2C1C2
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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 C30H23NO5 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23NO5/c1-15(32)19-11-8-16-4-2-3-5-20(16)27(19)36-30(35)17-6-9-18(10-7-17)31-28(33)25-21-12-13-22(24-14-23(21)24)26(25)29(31)34/h2-13,21-26H,14H2,1H3InChIKey
KIQJYNNGSDXKOC-UHFFFAOYSA-NSynonyms
2acetylnaphthalen1yl4(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)benzoate
CC(=O)C1=C(C2=CC=CC=C2C=C1)OC(=O)C3=CC=C(C=C3)N4C(=O)C5C6C=CC(C5C4=O)C7C6C7
InChI=1SC30H23NO5c115(32)1911816423520(16)27(19)3630(35)176918(10717)3128(33)2521121322(241423(21)24)26(25)29(31)34h2132126H14H21H3
MFCD02314704
ZINC000239331233
ZINC000239331236
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