Vitas-M small molecule compound
octamethyl 9',9''-(phenylmethanediyl)bis(5',5',6'-trimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate)
Catalog ID
STK527800
SMILES COC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2cc(ccc2N(C1(C)C)C)C(c1ccc2c(c1)C1=C(C(N2C)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)c1ccccc1)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 C57H54N2O16S6 MW 1215.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C57H54N2O16S6/c1-54(2)44-34(56(36(46(60)68-7)38(76-44)48(62)70-9)78-40(50(64)72-11)41(79-56)51(65)73-12)29-24-27(20-22-31(29)58(54)5)33(26-18-16-15-17-19-26)28-21-23-32-30(25-28)35-45(55(3,4)59(32)6)77-39(49(63)71-10)37(47(61)69-8)57(35)80-42(52(InChIKey
OMAQEPQCKVAPDZ-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=C(N1C)C=CC(=C3)C(C4=CC=CC=C4)C5=CC6=C(C=C5)N(C(C7=C6C8(C(=C(S7)C(=O)OC)C(=O)OC)SC(=C(S8)C(=O)OC)C(=O)OC)(C)C)C)C9(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S9)C(=O)OC)C(=O)OC)C
InChI=1SC57H54N2O16S6c154(2)4434(56(36(46(60)687)38(7644)48(62)709)7840(50(64)7211)41(7956)51(65)7312)292427(202231(29)58(54)5)33(26181615171926)2821233230(2528)3545(55(34)59(32)6)7739(49(63)7110)37(47(61)698)57(35)8042(52(66)7413)43(8157)53(67)7514h
MFCD02162615
octamethyl99(phenylmethanediyl)bis(556trimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate)
tetramethyl556trimethyl9(phenyl(2345tetrakis(methoxycarbonyl)556trimethylspiro(13dithiole21thiopyrano(23c)quinoline)9yl)methyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
Check stock
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Check stock on Vitas-MAvailable files
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