Vitas-M small molecule compound
tetramethyl 6'-hexanoyl-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK325137
SMILES CCCCCC(=O)N1c2ccccc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)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 C30H33NO9S3 MW 647.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO9S3/c1-8-9-10-15-18(32)31-17-14-12-11-13-16(17)19-24(29(31,2)3)41-21(26(34)38-5)20(25(33)37-4)30(19)42-22(27(35)39-6)23(43-30)28(36)40-7/h11-14H,8-10,15H2,1-7H3InChIKey
NAETYWLQFOIMEK-UHFFFAOYSA-NSynonyms
CCCCCC(=O)N1C2=CC=CC=C2C3=C(C1(C)C)SC(=C(C34SC(=C(S4)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
CCCCCC(=O)N1c2ccccc2C2=C(C1(C)C)SC(=C((C@@)12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC30H33NO9S3c189101518(32)31171412111316(17)1924(29(312)3)4121(26(34)385)20(25(33)374)30(19)4222(27(35)396)23(4330)28(36)407h1114H81015H217H3
MFCD00486105
tetramethyl6hexanoyl55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6hexanoyl55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6hexanoyl55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000008386803
ZINC08386803
ZINC8386803
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.