Vitas-M small molecule compound
4,7-diethyl-2-(4-methoxyphenyl)-5,6-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Catalog ID
STK710408
SMILES CCC12C3C(=O)N(C(=O)C3C(C2=O)(C(=C1c1ccccc1)c1ccccc1)CC)c1ccc(cc1)OC
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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 C32H29NO4 MW 491.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29NO4/c1-4-31-24(20-12-8-6-9-13-20)25(21-14-10-7-11-15-21)32(5-2,30(31)36)27-26(31)28(34)33(29(27)35)22-16-18-23(37-3)19-17-22/h6-19,26-27H,4-5H2,1-3H3InChIKey
ZFKLYIBAZVXTHY-UHFFFAOYSA-NSynonyms
(3aR4R7S7aS)47diethyl2(4methoxyphenyl)56diphenyl3a477atetrahydro1H47methanoisoindole138(2H)trione
47diethyl2(4methoxyphenyl)56diphenyl3a477atetrahydro1H47methanoisoindole138(2H)trione
CCC12C3C(=O)N(C(=O)(C@H)3C(C2=O)(C(=C1c1ccccc1)c1ccccc1)CC)c1ccc(cc1)OC
CCC12C3C(C(=O)N(C3=O)C4=CC=C(C=C4)OC)C(C1=O)(C(=C2C5=CC=CC=C5)C6=CC=CC=C6)CC
InChI=1SC32H29NO4c143124(20128691320)25(2114107111521)32(5230(31)36)2726(31)28(34)33(29(27)35)22161823(373)191722h6192627H45H213H3
MFCD00686281
ZINC000002294085
ZINC000006632117
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