L-Aspartic acid, N-[[3-(β-D-glucopyranosyloxy)-2,3-dihydro-2-oxo-1H-indol-3-yl]acetyl]-

CAS Registry Number®

99694-85-6

CAS Name

L-Aspartic acid, N-[[3-(β-D-glucopyranosyloxy)-2,3-dihydro-2-oxo-1H-indol-3-yl]acetyl]-

Molecular Formula

C20H24N2O12

Molecular Mass

484.41

Cite this Page

L-Aspartic acid, N-[[3-(β-D-glucopyranosyloxy)-2,3-dihydro-2-oxo-1H-indol-3-yl]acetyl]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=99694-85-6 (retrieved 2024-12-22) (CAS RN: 99694-85-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H24N2O12/c23-7-11-14(27)15(28)16(29)18(33-11)34-20(8-3-1-2-4-9(8)22-19(20)32)6-12(24)21-10(17(30)31)5-13(25)26/h1-4,10-11,14-16,18,23,27-29H,5-7H2,(H,21,24)(H,22,32)(H,25,26)(H,30,31)/t10-,11+,14+,15-,16+,18-,20?/m0/s1

InChIKey

InChIKey=ANAVISFXAGVRIA-VSHICFTDSA-N

SMILES

O(C1(CC(N[C@@H](CC(O)=O)C(O)=O)=O)C=2C(NC1=O)=CC=CC2)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O

Canonical SMILES

O=C(O)CC(NC(=O)CC1(OC2OC(CO)C(O)C(O)C2O)C(=O)NC=3C=CC=CC31)C(=O)O

Other Names for this Substance

  • L-Aspartic acid, N-[[3-(β-D-glucopyranosyloxy)-2,3-dihydro-2-oxo-1H-indol-3-yl]acetyl]-

CAS INSIGHTSTM
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