Vitas-M small molecule compound
2-[4-(4-tert-butylphenoxy)phenyl]hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STK359343
SMILES CC(c1ccc(cc1)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)(C)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 C27H27NO3 MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO3/c1-27(2,3)15-4-8-17(9-5-15)31-18-10-6-16(7-11-18)28-25(29)23-19-12-13-20(22-14-21(19)22)24(23)26(28)30/h4-13,19-24H,14H2,1-3H3InChIKey
ZGCLRGHZIOQNLH-UHFFFAOYSA-NSynonyms
2(4(4tertbutylphenoxy)phenyl)hexahydro46ethenocyclopropa(f)isoindole13(2H3aH)dione
CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC27H27NO3c127(23)154817(9515)311810616(71118)2825(29)2319121320(221421(19)22)24(23)26(28)30h4131924H14H213H3
MFCD02314616
ZINC000245226482
ZINC000245226485
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