β-D-Glucopyranoside, 4-aminophenyl 4-O-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-1-thio-, 2,3,6-triacetate
CAS Registry Number®
68636-50-0
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CAS Name
β-D-Glucopyranoside, 4-aminophenyl 4-O-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-1-thio-, 2,3,6-triacetateMolecular Formula
C32H41NO17SMolecular Mass
743.73Cite this Page
β-D-Glucopyranoside, 4-aminophenyl 4-O-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-1-thio-, 2,3,6-triacetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=68636-50-0 (retrieved ) (CAS RN: 68636-50-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C32H41NO17S/c1-14(34)41-12-23-25(43-16(3)36)27(44-17(4)37)29(46-19(6)39)31(48-23)50-26-24(13-42-15(2)35)49-32(51-22-10-8-21(33)9-11-22)30(47-20(7)40)28(26)45-18(5)38/h8-11,23-32H,12-13,33H2,1-7H3/t23-,24-,25-,26-,27+,28+,29-,30-,31+,32+/m1/s1
InChIKey
InChIKey=MZPWTWYHBZEZSN-CBUXPLGESA-N
SMILES
O([C@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](SC2=CC=C(N)C=C2)O[C@@H]1COC(C)=O)[C@H]3[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O3
Canonical SMILES
O=C(OCC1OC(OC2C(OC(SC3=CC=C(N)C=C3)C(OC(=O)C)C2OC(=O)C)COC(=O)C)C(OC(=O)C)C(OC(=O)C)C1OC(=O)C)C
Other Names for this Substance
- β-D-Glucopyranoside, 4-aminophenyl 4-O-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-1-thio-, 2,3,6-triacetate
