Vitas-M small molecule compound
methyl 3-butanoyl-4-(heptylamino)-6,6-dimethyl-2-oxocyclohex-3-ene-1-carboxylate
Catalog ID
STL563066
SMILES CCCC(=O)C1=C(NCCCCCCC)CC(C(C1=O)C(=O)OC)(C)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 C21H35NO4 MW 365.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H35NO4/c1-6-8-9-10-11-13-22-15-14-21(3,4)18(20(25)26-5)19(24)17(15)16(23)12-7-2/h18,22H,6-14H2,1-5H3InChIKey
PBBGNTOZCRYZCV-UHFFFAOYSA-NSynonyms
methyl3butanoyl4(heptylamino)66dimethyl2oxocyclohex3ene1carboxylate
methyl3butyryl4(heptylamino)66dimethyl2oxocyclohex3enecarboxylate
ZINC000100319794
ZINC000100319800
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