β-D-Glucopyranosyl (3β)-3-[(O-β-D-glucopyranosyl-(1→3)-O-[β-D-glucopyranosyl-(1→4)]-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
CAS Registry Number®
CAS Name
β-D-Glucopyranosyl (3β)-3-[(O-β-D-glucopyranosyl-(1→3)-O-[β-D-glucopyranosyl-(1→4)]-β-D-glucopyranosyl)oxy]olean-12-en-28-oateMolecular Formula
C54H88O23Molecular Mass
1105.26Cite this Page
β-D-Glucopyranosyl (3β)-3-[(O-β-D-glucopyranosyl-(1→3)-O-[β-D-glucopyranosyl-(1→4)]-β-D-glucopyranosyl)oxy]olean-12-en-28-oate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=144077-05-4 (retrieved ) (CAS RN: 144077-05-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C54H88O23/c1-49(2)14-16-54(48(69)77-46-40(67)37(64)34(61)27(21-57)72-46)17-15-52(6)23(24(54)18-49)8-9-30-51(5)12-11-31(50(3,4)29(51)10-13-53(30,52)7)74-47-41(68)43(76-45-39(66)36(63)33(60)26(20-56)71-45)42(28(22-58)73-47)75-44-38(65)35(62)32(59)25(19-55)70-44/h8,24-47,55-68H,9-22H2,1-7H3
InChIKey
InChIKey=MUJBUNJXXCRGGT-UHFFFAOYSA-N
SMILES
C(OC1OC(CO)C(O)C(O)C1O)(=O)C23C(C=4C(C)(CC2)C5(C)C(CC4)C6(C)C(CC5)C(C)(C)C(OC7C(O)C(OC8OC(CO)C(O)C(O)C8O)C(OC9OC(CO)C(O)C(O)C9O)C(CO)O7)CC6)CC(C)(C)CC3
Canonical SMILES
O=C(OC1OC(CO)C(O)C(O)C1O)C23CCC(C)(C)CC3C4=CCC5C6(C)CCC(OC7OC(CO)C(OC8OC(CO)C(O)C(O)C8O)C(OC9OC(CO)C(O)C(O)C9O)C7O)C(C)(C)C6CCC5(C)C4(C)CC2
Other Names for this Substance
- Olean-12-en-28-oic acid, 3-[(O-β-D-glucopyranosyl-(1→3)-O-[β-D-glucopyranosyl-(1→4)]-β-D-glucopyranosyl)oxy]-, β-D-glucopyranosyl ester, (3β)-
- β-D-Glucopyranosyl (3β)-3-[(O-β-D-glucopyranosyl-(1→3)-O-[β-D-glucopyranosyl-(1→4)]-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
- Araloside G