Vitas-M small molecule compound

quinolin-8-yl 2,3,4,6-tetra-O-acetyl-1-thio-D-glucopyranoside

Catalog ID
STK039459
SMILES CC(=O)OC[C@H]1OC(Sc2cccc3c2nccc3)[C@@H]([C@H]([C@@H]1OC(=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 C23H25NO9S MW 491.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO9S/c1-12(25)29-11-17-20(30-13(2)26)21(31-14(3)27)22(32-15(4)28)23(33-17)34-18-9-5-7-16-8-6-10-24-19(16)18/h5-10,17,20-23H,11H2,1-4H3/t17-,20-,21+,22-,23?/m1/s1
InChIKey
KQXHMDSINZTSAB-NODAHLOSSA-N
Synonyms
485753-20-6
((2R3R4S5R)345triacetyloxy6quinolin8ylsulfanyloxan2yl)methylacetate
(2R3S4S5R6S)2(acetoxymethyl)6(quinolin8ylthio)tetrahydro2Hpyran345triyltriacetate
485753206
CC(=O)OC(C@H)1O(C@@H)(Sc2cccc3c2nccc3)(C@@H)((C@H)((C@H)1OC(=O)C)OC(=O)C)OC(=O)C
CC(=O)OC(C@H)1OC(Sc2cccc3c2nccc3)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)OC(=O)C
CC(=O)OCC1C(C(C(C(O1)SC2=CC=CC3=C2N=CC=C3)OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC23H25NO9Sc112(25)29111720(3013(2)26)21(3114(3)27)22(3215(4)28)23(3317)34189571686102419(16)18h510172023H11H214H3t172021+2223?m1s1
MFCD03321370
quinolin8yl2346tetraOacetyl1thioDglucopyranoside
STK039459
ZINC000008691583
ZINC000009425455

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.