Vitas-M small molecule compound
1-pentyl-1H-benzimidazol-2-yl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thio-beta-D-glucopyranoside
Catalog ID
STL009191
SMILES CCCCCn1c(S[C@@H]2O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]2NC(=O)C)OC(=O)C)OC(=O)C)nc2c1cccc2
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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 C26H35N3O8S MW 549.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35N3O8S/c1-6-7-10-13-29-20-12-9-8-11-19(20)28-26(29)38-25-22(27-15(2)30)24(36-18(5)33)23(35-17(4)32)21(37-25)14-34-16(3)31/h8-9,11-12,21-25H,6-7,10,13-14H2,1-5H3,(H,27,30)/t21-,22-,23-,24-,25+/m1/s1InChIKey
JMXRWUUMWFWGPS-JYSSUKAJSA-NSynonyms
956995-52-1((2R3S4R5R6S)5acetamido34diacetyloxy6(1pentylbenzimidazol2yl)sulfanyloxan2yl)methylacetate
(2R3S4R5R6S)5acetamido2(acetoxymethyl)6((1pentyl1Hbenzo(d)imidazol2yl)thio)tetrahydro2Hpyran34diyldiacetate
1PENTYL1HBENZIMIDAZOL2YL346TRIOACETYL2(ACETYLAMINO)2DEOXY1THIOBETADGLUCOPYRANOSIDE
956995521
CCCCCn1c(S(C@@H)2O(C@H)(COC(=O)C)(C@H)((C@@H)((C@H)2NC(=O)C)OC(=O)C)OC(=O)C)nc2c1cccc2
CCCCCN1C2=CC=CC=C2N=C1SC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C
InChI=1SC26H35N3O8Sc1671013292012981119(20)2826(29)382522(2715(2)30)24(3618(5)33)23(3517(4)32)21(3725)143416(3)31h8911122125H67101314H215H3(H2730)t2122232425+m1s1
MFCD09842973
ZINC000070712109
ZINC70712109
Check stock
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Check stock on Vitas-MAvailable files
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