29-Methyl (3β,20β)-3-[(4-O-β-D-galactopyranosyl-β-D-galactopyranosyl)oxy]olean-12-ene-28,29-dioate
CAS Registry Number®
80311-28-0
CAS Name
29-Methyl (3β,20β)-3-[(4-O-β-D-galactopyranosyl-β-D-galactopyranosyl)oxy]olean-12-ene-28,29-dioateMolecular Formula
C43H68O15Molecular Mass
824.99Cite this Page
29-Methyl (3β,20β)-3-[(4-O-β-D-galactopyranosyl-β-D-galactopyranosyl)oxy]olean-12-ene-28,29-dioate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=80311-28-0 (retrieved ) (CAS RN: 80311-28-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C43H68O15/c1-38(2)25-10-13-42(6)26(9-8-21-22-18-39(3,37(53)54-7)14-16-43(22,36(51)52)17-15-41(21,42)5)40(25,4)12-11-27(38)57-34-32(50)30(48)33(24(20-45)56-34)58-35-31(49)29(47)28(46)23(19-44)55-35/h8,22-35,44-50H,9-20H2,1-7H3,(H,51,52)
InChIKey
InChIKey=IDTIOCYBMWJUGJ-UHFFFAOYSA-N
SMILES
C(O)(=O)C12C(C=3C(C)(C4(C)C(CC3)C5(C)C(CC4)C(C)(C)C(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)CC5)CC1)CC(C(OC)=O)(C)CC2
Canonical SMILES
O=C(O)C12CCC(C(=O)OC)(C)CC2C3=CCC4C5(C)CCC(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC1
Other Names for this Substance
- Olean-12-ene-28,29-dioic acid, 3-[(4-O-β-D-galactopyranosyl-β-D-galactopyranosyl)oxy]-, 29-methyl ester, (3β,20β)-
- 29-Methyl (3β,20β)-3-[(4-O-β-D-galactopyranosyl-β-D-galactopyranosyl)oxy]olean-12-ene-28,29-dioate
- Yiamoloside B