Vitas-M small molecule compound
benzyl N-[(2E)-2-[(furan-2-ylcarbonyl)amino]-3-(3-nitrophenyl)prop-2-enoyl]leucinate
Catalog ID
STK830586
SMILES CC(CC(C(=O)OCc1ccccc1)NC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccco1)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 C27H27N3O7 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O7/c1-18(2)14-23(27(33)37-17-19-8-4-3-5-9-19)29-25(31)22(28-26(32)24-12-7-13-36-24)16-20-10-6-11-21(15-20)30(34)35/h3-13,15-16,18,23H,14,17H2,1-2H3,(H,28,32)(H,29,31)/b22-16+InChIKey
YADKQINMTPWLBG-CJLVFECKSA-NSynonyms
BENZYL2(((E)2(FURAN2CARBONYLAMINO)3(3NITROPHENYL)PROP2ENOYL)AMINO)4METHYLPENTANOATE
benzyl2(2(furan2carboxamido)3(3nitrophenyl)acrylamido)4methylpentanoate
benzylN((2E)2((furan2ylcarbonyl)amino)3(3nitrophenyl)prop2enoyl)leucinate
CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)C(=CC2=CC(=CC=C2)(N+)(=O)(O))NC(=O)C3=CC=CO3
CC(CC(C(=O)OCc1ccccc1)NC(=O)C(=Cc1cccc(c1)(N+)(=O)(O))NC(=O)c1ccco1)C
InChI=1SC27H27N3O7c118(2)1423(27(33)3717198435919)2925(31)22(2826(32)24127133624)16201061121(1520)30(34)35h31315161823H1417H212H3(H2832)(H2931)b2216+
MFCD01946054
ZINC000008742425
ZINC000008742426
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