Vitas-M small molecule compound
5-hydroxy-1,4-dioxo-3-[(2,3,4,6-tetra-O-acetylhexopyranosyl)oxy]-1,4-dihydronaphthalen-2-yl 2,3,4,6-tetra-O-acetylhexopyranoside
Catalog ID
STL528784
SMILES CC(=O)OCC1OC(OC2=C(OC3OC(COC(=O)C)C(C(C3OC(=O)C)OC(=O)C)OC(=O)C)C(=O)c3c(C2=O)c(O)ccc3)C(C(C1OC(=O)C)OC(=O)C)OC(=O)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 C38H42O23 MW 866.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H42O23/c1-14(39)50-12-24-29(52-16(3)41)33(54-18(5)43)35(56-20(7)45)37(58-24)60-31-27(48)22-10-9-11-23(47)26(22)28(49)32(31)61-38-36(57-21(8)46)34(55-19(6)44)30(53-17(4)42)25(59-38)13-51-15(2)40/h9-11,24-25,29-30,33-38,47H,12-13H2,1-8H3InChIKey
COICYYHTLYZMEX-UHFFFAOYSA-NSynonyms
(345TRIACETYLOXY6(5HYDROXY14DIOXO3(345TRIACETYLOXY6(ACETYLOXYMETHYL)OXAN2YL)OXYNAPHTHALEN2YL)OXYOXAN2YL)METHYLACETATE
(345tris(acetyloxy)6((5hydroxy14dioxo3((345tris(acetyloxy)6((acetyloxy)methyl)oxan2yl)oxy)14dihydronaphthalen2yl)oxy)oxan2yl)methylacetate
5158722
5hydroxy14dioxo3((2346tetraOacetylhexopyranosyl)oxy)14dihydronaphthalen2yl2346tetraOacetylhexopyranoside
InChI=1SC38H42O23c114(39)50122429(5216(3)41)33(5418(5)43)35(5620(7)45)37(5824)603127(48)221091123(47)26(22)28(49)32(31)613836(5721(8)46)34(5519(6)44)30(5317(4)42)25(5938)135115(2)40h91124252930333847H1213H218H3
MFCD01544050
ZINC000253504412
ZINC000253504418
Check stock
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Check stock on Vitas-MAvailable files
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