Vitas-M small molecule compound
2-(3-nitrophenyl)-2-oxoethyl 2,6-bis(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
Catalog ID
STK674596
SMILES O=C(C(N1C(=O)C2C(C1=O)C1CC2CC1)CCCCN1C(=O)C2C(C1=O)C1CC2CC1)OCC(=O)c1cccc(c1)[N+](=O)[O-]
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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 C32H35N3O9 MW 605.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H35N3O9/c36-23(16-4-3-5-21(14-16)35(42)43)15-44-32(41)22(34-30(39)26-19-9-10-20(13-19)27(26)31(34)40)6-1-2-11-33-28(37)24-17-7-8-18(12-17)25(24)29(33)38/h3-5,14,17-20,22,24-27H,1-2,6-13,15H2InChIKey
KCNYGPBHCOZNPB-UHFFFAOYSA-NSynonyms
2(3nitrophenyl)2oxoethyl26bis(13dioxooctahydro2H47methanoisoindol2yl)hexanoate
C1CC2CC1C3C2C(=O)N(C3=O)CCCCC(C(=O)OCC(=O)C4=CC(=CC=C4)(N+)(=O)(O))N5C(=O)C6C7CCC(C7)C6C5=O
InChI=1SC32H35N3O9c3623(1643521(1416)35(42)43)154432(41)22(3430(39)261991020(1319)27(26)31(34)40)612113328(37)24177818(1217)25(24)29(33)38h35141720222427H1261315H2
MFCD01156425
O=C(C(N1C(=O)C2C(C1=O)C1CC2CC1)CCCCN1C(=O)C2C(C1=O)C1CC2CC1)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000245235431
ZINC000245235434
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.