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4-cyclopentyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thio-beta-D-glucopyranoside

Catalog ID
STL535592
SMILES CC(=O)OC[C@H]1O[C@@H](Sc2nnc(n2C2CCCC2)COc2ccccc2C)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=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 C29H38N4O9S MW 618.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N4O9S/c1-16-10-6-9-13-22(16)39-15-24-31-32-29(33(24)21-11-7-8-12-21)43-28-25(30-17(2)34)27(41-20(5)37)26(40-19(4)36)23(42-28)14-38-18(3)35/h6,9-10,13,21,23,25-28H,7-8,11-12,14-15H2,1-5H3,(H,30,34)/t23-,25-,26-,27-,28+/m1/s1
InChIKey
MTORMZIRSIPPMN-LZEBPPIWSA-N
Synonyms
1014058-76-4
((2~(R)3~(S)4~(R)5~(R)6~(S))5acetamido34diacetyloxy6((4cyclopentyl5((2methylphenoxy)methyl)124triazol3yl)sulfanyl)oxan2yl)methylacetate
(2R3S4R5R6S)5acetamido2(acetoxymethyl)6((4cyclopentyl5((otolyloxy)methyl)4H124triazol3yl)thio)tetrahydro2Hpyran34diyldiacetate
1014058764
17572026
4cyclopentyl5((2methylphenoxy)methyl)4H124triazol3yl346triOacetyl2(acetylamino)2deoxy1thiobetaDglucopyranoside
CC(=O)OC(C@H)1O(C@@H)(Sc2nnc(n2C2CCCC2)COc2ccccc2C)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)NC(=O)C
InChI=1SC29H38N4O9Sc11610691322(16)391524313229(33(24)2111781221)432825(3017(2)34)27(4120(5)37)26(4019(4)36)23(4228)143818(3)35h69101321232528H7811121415H215H3(H3034)t2325262728+m1s1
MFCD09843696
ZINC000070712244
ZINC70712244

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Available files

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