Olean-12-en-28-oic acid, 3,23-bis(β-D-glucopyranosyloxy)-, 3-O-β-D-glucopyranosyl-α-L-arabinopyranosyl ester, (3β,4α)-
CAS Registry Number®
CAS Name
Olean-12-en-28-oic acid, 3,23-bis(β-D-glucopyranosyloxy)-, 3-O-β-D-glucopyranosyl-α-L-arabinopyranosyl ester, (3β,4α)-Molecular Formula
C53H86O23Molecular Mass
1091.24Cite this Page
Olean-12-en-28-oic acid, 3,23-bis(β-D-glucopyranosyloxy)-, 3-O-β-D-glucopyranosyl-α-L-arabinopyranosyl ester, (3β,4α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=123597-11-5 (retrieved ) (CAS RN: 123597-11-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C53H86O23/c1-48(2)13-15-53(47(68)76-44-41(67)42(25(57)21-69-44)75-46-40(66)37(63)34(60)28(20-56)73-46)16-14-51(5)23(24(53)17-48)7-8-30-49(3)11-10-31(74-45-39(65)36(62)33(59)27(19-55)72-45)50(4,29(49)9-12-52(30,51)6)22-70-43-38(64)35(61)32(58)26(18-54)71-43/h7,24-46,54-67H,8-22H2,1-6H3/t24-,25-,26+,27+,28+,29+,30+,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41+,42-,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1
InChIKey
InChIKey=UCOFFSFKNNIOHI-NGPMYKJHSA-N
SMILES
C(O[C@H]1[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)CO1)(=O)[C@]34[C@](C=5[C@@](C)(CC3)[C@@]6(C)[C@](CC5)([C@]7(C)[C@@](CC6)([C@@](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)(C)[C@@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)CC7)[H])[H])(CC(C)(C)CC4)[H]
Canonical SMILES
O=C(OC1OCC(O)C(OC2OC(CO)C(O)C(O)C2O)C1O)C34CCC(C)(C)CC4C5=CCC6C7(C)CCC(OC8OC(CO)C(O)C(O)C8O)C(C)(COC9OC(CO)C(O)C(O)C9O)C7CCC6(C)C5(C)CC3
Other Names for this Substance
- Olean-12-en-28-oic acid, 3,23-bis(β-D-glucopyranosyloxy)-, 3-O-β-D-glucopyranosyl-α-L-arabinopyranosyl ester, (3β,4α)-
- Quinoside A
- Quinoside A (triterpene glycoside)