Vitas-M small molecule compound
2-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK843200
SMILES OCC(C(c1ccc(cc1)[N+](=O)[O-])O)N1C(=O)C2C(C1=O)C1CC2C=C1
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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 C18H18N2O6 MW 358.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O6/c21-8-13(16(22)9-3-5-12(6-4-9)20(25)26)19-17(23)14-10-1-2-11(7-10)15(14)18(19)24/h1-6,10-11,13-16,21-22H,7-8H2InChIKey
LBCYYMHCYKZZAX-UHFFFAOYSA-NSynonyms
430428-96-9(3AR4R7R7AS)2((1S2R)13DIHYDROXY1(4NITROPHENYL)PROPAN2YL)3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
2(13dihydroxy1(4nitrophenyl)propan2yl)3a477atetrahydro1H47methanoisoindole13(2H)dione
430428969
C1C2C=CC1C3C2C(=O)N(C3=O)C(CO)C(C4=CC=C(C=C4)(N+)(=O)(O))O
InChI=1SC18H18N2O6c21813(16(22)93512(649)20(25)26)1917(23)14101211(710)15(14)18(19)24h16101113162122H78H2
MFCD01412982
OCC(C(c1ccc(cc1)(N+)(=O)(O))O)N1C(=O)C2C(C1=O)C1CC2C=C1
ZINC000100631967
ZINC000100631976
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