Vitas-M small molecule compound
methyl (5E)-5-(1-aminooctadecylidene)-2,2-dimethyl-4,6-dioxocyclohexanecarboxylate
Catalog ID
STK622706
SMILES CCCCCCCCCCCCCCCCC/C(=C\1/C(=O)CC(C(C1=O)C(=O)OC)(C)C)/N
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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 C28H49NO4 MW 463.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H49NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(29)24-23(30)21-28(2,3)25(26(24)31)27(32)33-4/h25H,5-21,29H2,1-4H3/b24-22+InChIKey
JUNFKFIPDNHRLX-ZNTNEXAZSA-NSynonyms
(E)methyl5(1aminooctadecylidene)22dimethyl46dioxocyclohexanecarboxylate
CCCCCCCCCCCCCCCCCC(=C1C(=O)CC(C(C1=O)C(=O)OC)(C)C)N
InChI=1SC28H49NO4c156789101112131415161718192022(29)2423(30)2128(23)25(26(24)31)27(32)334h25H52129H214H3b2422+
METHYL(5E)5(1AMINOOCTADECYLIDENE)22DIMETHYL46DIOXOCYCLOHEXANE1CARBOXYLATE
methyl(5E)5(1aminooctadecylidene)22dimethyl46dioxocyclohexanecarboxylate
MFCD00564168
ZINC000101277350
ZINC000101277352
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