Vitas-M small molecule compound
1-oxo-1-phenylpropan-2-yl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)-3-phenylpropanoate
Catalog ID
STK388369
SMILES O=C(C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Cc1ccccc1)OC(C(=O)c1ccccc1)C
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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 C29H27NO5 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO5/c1-16(26(31)18-10-6-3-7-11-18)35-29(34)23(14-17-8-4-2-5-9-17)30-27(32)24-19-12-13-20(22-15-21(19)22)25(24)28(30)33/h2-13,16,19-25H,14-15H2,1H3InChIKey
ODSGXGCRTGDBAH-UHFFFAOYSA-NSynonyms
1oxo1phenylpropan2yl2(13dioxo33a44a55a66aoctahydro46ethenocyclopropa(f)isoindol2(1H)yl)3phenylpropanoate
1OXO1PHENYLPROPAN2YL2(13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)3PHENYLPROPANOATE
CC(C(=O)C1=CC=CC=C1)OC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC29H27NO5c116(26(31)18106371118)3529(34)23(14178425917)3027(32)2419121320(221521(19)22)25(24)28(30)33h213161925H1415H21H3
MFCD02189115
ZINC000239377889
ZINC000239377896
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