Vitas-M small molecule compound
cyclopentyl 4-(2,3-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK012017
SMILES COc1cccc(c1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCC1
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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 C26H33NO5 MW 439.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO5/c1-15-21(25(29)32-16-9-6-7-10-16)22(17-11-8-12-20(30-4)24(17)31-5)23-18(27-15)13-26(2,3)14-19(23)28/h8,11-12,16,22,27H,6-7,9-10,13-14H2,1-5H3InChIKey
GPJHHQHGICKCPD-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C(=CC=C3)OC)OC)C(=O)OC4CCCC4
COc1cccc(c1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCC1
cyclopentyl4(23dimethoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(23dimethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC26H33NO5c11521(25(29)32169671016)22(171181220(304)24(17)315)2318(2715)1326(23)1419(23)28h81112162227H679101314H215H3
MFCD00753069
STK012017
ZINC000019535743
ZINC000019535745
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