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4,5-diphenyl-4H-1,2,4-triazol-3-yl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thio-beta-D-glucopyranoside

Catalog ID
STL009562
SMILES CC(=O)OC[C@H]1O[C@@H](Sc2nnc(n2c2ccccc2)c2ccccc2)[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 C28H30N4O8S MW 582.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O8S/c1-16(33)29-23-25(39-19(4)36)24(38-18(3)35)22(15-37-17(2)34)40-27(23)41-28-31-30-26(20-11-7-5-8-12-20)32(28)21-13-9-6-10-14-21/h5-14,22-25,27H,15H2,1-4H3,(H,29,33)/t22-,23-,24-,25-,27+/m1/s1
InChIKey
IXWQRHYNPGPQKG-CMSSPHMHSA-N
Synonyms
956922-73-9
((2R3S4R5R6S)5acetamido34diacetyloxy6((45diphenyl124triazol3yl)sulfanyl)oxan2yl)methylacetate
(2R3S4R5R6S)5acetamido2(acetoxymethyl)6((45diphenyl4H124triazol3yl)thio)tetrahydro2Hpyran34diyldiacetate
3(2(ACETYLAMINO)3O4O6OTRIACETYL2DEOXYBETADGLUCOPYRANOSYLTHIO)45DIPHENYL4H124TRIAZOLE
45DIPHENYL4H124TRIAZOL3YL346TRIOACETYL2(ACETYLAMINO)2DEOXY1THIOBETADGLUCOPYRANOSIDE
956922739
CC(=O)NC1C(C(C(OC1SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)COC(=O)C)OC(=O)C)OC(=O)C
CC(=O)OC(C@H)1O(C@@H)(Sc2nnc(n2c2ccccc2)c2ccccc2)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)NC(=O)C
InChI=1SC28H30N4O8Sc116(33)292325(3919(4)36)24(3818(3)35)22(153717(2)34)4027(23)4128313026(20117581220)32(28)211396101421h514222527H15H214H3(H2933)t2223242527+m1s1
MFCD09842975
ZINC000070712112
ZINC70712112

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Available files

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