Vitas-M small molecule compound
tetramethyl 6'-(3-cyclohexylpropanoyl)-8'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK789866
SMILES COc1ccc2c(c1)N(C(=O)CCC1CCCCC1)C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)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 C34H39NO10S3 MW 717.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39NO10S3/c1-33(2)28-23(20-15-14-19(41-3)17-21(20)35(33)22(36)16-13-18-11-9-8-10-12-18)34(24(29(37)42-4)25(46-28)30(38)43-5)47-26(31(39)44-6)27(48-34)32(40)45-7/h14-15,17-18H,8-13,16H2,1-7H3InChIKey
RNZVLRKUFHHNIJ-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=C(N1C(=O)CCC4CCCCC4)C=C(C=C3)OC)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
InChI=1SC34H39NO10S3c133(2)2823(20151419(413)1721(20)35(33)22(36)1613181198101218)34(24(29(37)424)25(4628)30(38)435)4726(31(39)446)27(4834)32(40)457h14151718H81316H217H3
MFCD01946756
tetramethyl6(3cyclohexylpropanoyl)8methoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(3cyclohexylpropanoyl)8methoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(3cyclohexylpropanoyl)8methoxy55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000096022218
ZINC96022218
Check stock
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Check stock on Vitas-MAvailable files
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