Vitas-M small molecule compound
cyclohexyl 4-(4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372333
SMILES Oc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1
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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 C25H31NO4 MW 409.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO4/c1-15-21(24(29)30-18-7-5-4-6-8-18)22(16-9-11-17(27)12-10-16)23-19(26-15)13-25(2,3)14-20(23)28/h9-12,18,22,26-27H,4-8,13-14H2,1-3H3InChIKey
RLXAZLDAPSODOC-UHFFFAOYSA-NSynonyms
299451-16-4299451164
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)O)C(=O)OC4CCCCC4
cyclohexyl4(4hydroxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(4hydroxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC25H31NO4c11521(24(29)30187546818)22(1691117(27)121016)2319(2615)1325(23)1420(23)28h91218222627H481314H213H3
MFCD00771000
PICOLINICACIDTHIOOBUTYLESTER
ZINC000019731654
ZINC000019731656
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