Vitas-M small molecule compound
1-hexyl-1H-benzimidazol-2-yl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thio-beta-D-glucopyranoside
Catalog ID
STL011048
SMILES CCCCCCn1c(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 C27H37N3O8S MW 563.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H37N3O8S/c1-6-7-8-11-14-30-21-13-10-9-12-20(21)29-27(30)39-26-23(28-16(2)31)25(37-19(5)34)24(36-18(4)33)22(38-26)15-35-17(3)32/h9-10,12-13,22-26H,6-8,11,14-15H2,1-5H3,(H,28,31)/t22-,23-,24-,25-,26+/m1/s1InChIKey
YDYVPGKSISKRBH-SDVOOXDOSA-NSynonyms
956995-40-7((2R3S4R5R6S)5acetamido34diacetyloxy6(1hexylbenzimidazol2yl)sulfanyloxan2yl)methylacetate
(2R3S4R5R6S)5acetamido2(acetoxymethyl)6((1hexyl1Hbenzo(d)imidazol2yl)thio)tetrahydro2Hpyran34diyldiacetate
1HEXYL1HBENZIMIDAZOL2YL346TRIOACETYL2(ACETYLAMINO)2DEOXY1THIOBETADGLUCOPYRANOSIDE
956995407
CCCCCCn1c(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
CCCCCCN1C2=CC=CC=C2N=C1SC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C
InChI=1SC27H37N3O8Sc167811143021131091220(21)2927(30)392623(2816(2)31)25(3719(5)34)24(3618(4)33)22(3826)153517(3)32h91012132226H68111415H215H3(H2831)t2223242526+m1s1
MFCD09842924
ZINC000070712100
ZINC70712100
Check stock
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Check stock on Vitas-MAvailable files
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