Vitas-M small molecule compound

benzyl 2-(acetylamino)-4,6-O-benzylidene-3-O-(carboxymethyl)-2-deoxy-beta-D-glucopyranoside

Catalog ID
STK022836
SMILES OC(=O)CO[C@H]1[C@@H]2OC(OC[C@H]2O[C@H]([C@@H]1NC(=O)C)OCc1ccccc1)c1ccccc1

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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 C24H27NO8 MW 457.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO8/c1-15(26)25-20-22(29-14-19(27)28)21-18(13-31-23(33-21)17-10-6-3-7-11-17)32-24(20)30-12-16-8-4-2-5-9-16/h2-11,18,20-24H,12-14H2,1H3,(H,25,26)(H,27,28)/t18-,20-,21-,22-,23?,24-/m1/s1
InChIKey
KBBGPRDVHUWBLB-YSAWWDRSSA-N
Synonyms

2(((4aR6R7R8R8aS)7acetamido2phenyl6phenylmethoxy44a6788ahexahydropyrano(32d)(13)dioxin8yl)oxy)aceticacid
BENZYL2(ACETYLAMINO)46OBENZYLIDENE3O(CARBOXYMETHYL)2DEOXYBETADGLUCOPYRANOSIDE
CC(=O)NC1C(C2C(COC(O2)C3=CC=CC=C3)OC1OCC4=CC=CC=C4)OCC(=O)O
InChI=1SC24H27NO8c115(26)252022(291419(27)28)2118(133123(3321)17106371117)3224(20)3012168425916h211182024H1214H21H3(H2526)(H2728)t1820212223?24m1s1
MFCD13368296
OC(=O)CO(C@H)1(C@@H)2OC(OC(C@H)2O(C@H)((C@@H)1NC(=O)C)OCc1ccccc1)c1ccccc1
STK022836
ZINC000013940470
ZINC000013940471

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Available files

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