(2α,3β,4α)-3-(β-D-Glucopyranosyloxy)-2,23-dihydroxyolean-12-en-28-oic acid

CAS Registry Number®

99543-11-0

CAS Name

(2α,3β,4α)-3-(β-D-Glucopyranosyloxy)-2,23-dihydroxyolean-12-en-28-oic acid

Molecular Formula

C36H58O10

Molecular Mass

650.84

Cite this Page

(2α,3β,4α)-3-(β-D-Glucopyranosyloxy)-2,23-dihydroxyolean-12-en-28-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=99543-11-0 (retrieved 2024-11-22) (CAS RN: 99543-11-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H58O10/c1-31(2)11-13-36(30(43)44)14-12-34(5)19(20(36)15-31)7-8-24-32(3)16-21(39)28(33(4,18-38)23(32)9-10-35(24,34)6)46-29-27(42)26(41)25(40)22(17-37)45-29/h7,20-29,37-42H,8-18H2,1-6H3,(H,43,44)/t20-,21+,22+,23+,24+,25+,26-,27+,28-,29-,32-,33-,34+,35+,36-/m0/s1

InChIKey

InChIKey=ZOUJKJNUAOXJGL-XJWBRSAFSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@](CC1)([C@@](CO)(C)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)C3)[H])(CC=C5[C@@]2(C)CC[C@]6(C(O)=O)[C@]5(CC(C)(C)CC6)[H])[H]

Canonical SMILES

O=C(O)C12CCC(C)(C)CC2C3=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CC1

Other Names for this Substance

  • Olean-12-en-28-oic acid, 3-(β-D-glucopyranosyloxy)-2,23-dihydroxy-, (2α,3β,4α)-
  • (2α,3β,4α)-3-(β-D-Glucopyranosyloxy)-2,23-dihydroxyolean-12-en-28-oic acid
  • Lucyoside I
  • 3-O-β-Glucopyranosyl arjunolic acid

CAS INSIGHTSTM
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