Vitas-M small molecule compound
1-(2,3,4,6-tetra-O-acetylhexopyranosyl)-5-(1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl)-2,3-dihydro-1H-indole
Catalog ID
STK683034
SMILES COC(=O)C(C(F)(F)F)(c1ccc2c(c1)CCN2C1OC(COC(=O)C)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C)O
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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 C26H30F3NO12 MW 605.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30F3NO12/c1-12(31)38-11-19-20(39-13(2)32)21(40-14(3)33)22(41-15(4)34)23(42-19)30-9-8-16-10-17(6-7-18(16)30)25(36,24(35)37-5)26(27,28)29/h6-7,10,19-23,36H,8-9,11H2,1-5H3InChIKey
IJOAIKTXOURHMD-UHFFFAOYSA-NSynonyms
1(2346tetraOacetylhexopyranosyl)5(111trifluoro2hydroxy3methoxy3oxopropan2yl)23dihydro1Hindole
CC(=O)OCC1C(C(C(C(O1)N2CCC3=C2C=CC(=C3)C(C(=O)OC)(C(F)(F)F)O)OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC26H30F3NO12c112(31)38111920(3913(2)32)21(4014(3)33)22(4115(4)34)23(4219)3098161017(6718(16)30)25(3624(35)375)26(2728)29h6710192336H8911H215H3
METHYL333TRIFLUORO2HYDROXY2(1(345TRIACETYLOXY6(ACETYLOXYMETHYL)OXAN2YL)23DIHYDROINDOL5YL)PROPANOATE
MFCD04061855
ZINC000098005949
ZINC000245255460
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