28-(O-β-D-Xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl) (2β,3β,4α)-3-(β-D-glucopyranuronosyloxy)-2-hydroxyolean-12-ene-23,28-dioate

CAS Registry Number®

128192-15-4

CAS Name

28-(O-β-D-Xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl) (2β,3β,4α)-3-(β-D-glucopyranuronosyloxy)-2-hydroxyolean-12-ene-23,28-dioate

Molecular Formula

C52H80O24

Molecular Mass

1089.18

Cite this Page

28-(O-β-D-Xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl) (2β,3β,4α)-3-(β-D-glucopyranuronosyloxy)-2-hydroxyolean-12-ene-23,28-dioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=128192-15-4 (retrieved 2024-11-13) (CAS RN: 128192-15-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C52H80O24/c1-20-36(72-41-33(61)28(56)24(54)18-69-41)32(60)35(63)42(71-20)74-38-29(57)25(55)19-70-44(38)76-46(68)52-14-12-47(2,3)16-22(52)21-8-9-26-48(4)17-23(53)39(75-43-34(62)30(58)31(59)37(73-43)40(64)65)51(7,45(66)67)27(48)10-11-50(26,6)49(21,5)13-15-52/h8,20,22-39,41-44,53-63H,9-19H2,1-7H3,(H,64,65)(H,66,67)/t20-,22-,23-,24+,25-,26+,27+,28-,29-,30-,31-,32-,33+,34+,35+,36-,37-,38+,39-,41-,42-,43-,44-,48+,49+,50+,51-,52-/m0/s1

InChIKey

InChIKey=RPWKGRUCXRZSSG-AORISXJYSA-N

SMILES

C(O[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)[C@H](C)O2)[C@@H](O)[C@@H](O)CO1)(=O)[C@]45[C@](C=6[C@@](C)(CC4)[C@@]7(C)[C@](CC6)([C@]8(C)[C@@](CC7)([C@@](C(O)=O)(C)[C@@H](O[C@@H]9O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](O)C8)[H])[H])(CC(C)(C)CC5)[H]

Canonical SMILES

O=C(O)C1OC(OC2C(O)CC3(C)C(CCC4(C)C3CC=C5C6CC(C)(C)CCC6(C(=O)OC7OCC(O)C(O)C7OC8OC(C)C(OC9OCC(O)C(O)C9O)C(O)C8O)CCC54C)C2(C(=O)O)C)C(O)C(O)C1O

Other Names for this Substance

  • Olean-12-ene-23,28-dioic acid, 3-(β-D-glucopyranuronosyloxy)-2-hydroxy-, 28-(O-β-D-xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl) ester, (2β,3β,4α)-
  • 28-(O-β-D-Xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl) (2β,3β,4α)-3-(β-D-glucopyranuronosyloxy)-2-hydroxyolean-12-ene-23,28-dioate

Deleted or Replaced CAS Registry Numbers

868560-62-7, 152196-21-9, 189380-78-7

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles