Vitas-M small molecule compound
tetramethyl 6'-(3-cyclohexylpropanoyl)-5',5',8',9'-tetramethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK056771
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)c(c1)C)C(=O)CCC1CCCCC1)SC(=C(S2)C(=O)OC)C(=O)OC
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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 C35H41NO9S3 MW 715.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H41NO9S3/c1-18-16-21-22(17-19(18)2)36(23(37)15-14-20-12-10-9-11-13-20)34(3,4)29-24(21)35(25(30(38)42-5)26(46-29)31(39)43-6)47-27(32(40)44-7)28(48-35)33(41)45-8/h16-17,20H,9-15H2,1-8H3InChIKey
HCYONKCWCLDDNE-UHFFFAOYSA-NSynonyms
CC1=C(C=C2C(=C1)C3=C(C(N2C(=O)CCC4CCCCC4)(C)C)SC(=C(C35SC(=C(S5)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C
COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)c(c1)C)C(=O)CCC1CCCCC1)SC(=C(S2)C(=O)OC)C(=O)OC
InChI=1SC35H41NO9S3c118162122(1719(18)2)36(23(37)15142012109111320)34(34)2924(21)35(25(30(38)425)26(4629)31(39)436)4727(32(40)447)28(4835)33(41)458h161720H915H218H3
MFCD01563464
STK056771
tetramethyl6(3cyclohexylpropanoyl)5589tetramethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(3cyclohexylpropanoyl)5589tetramethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(3cyclohexylpropanoyl)5589tetramethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150392965
ZINC150392965
Check stock
See real-time availability and sample size for STK056771 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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