Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-23-oxo-, β-D-glucopyranosyl ester, (3β,4α)-
CAS Registry Number®
100179-68-8
CAS Name
Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-23-oxo-, β-D-glucopyranosyl ester, (3β,4α)-Molecular Formula
C48H76O19Molecular Mass
957.11Cite this Page
Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-23-oxo-, β-D-glucopyranosyl ester, (3β,4α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=100179-68-8 (retrieved ) (CAS RN: 100179-68-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C48H76O19/c1-43(2)13-15-48(42(61)67-40-37(60)34(57)31(54)25(19-50)63-40)16-14-46(5)22(23(48)17-43)7-8-28-44(3)11-10-29(45(4,21-52)27(44)9-12-47(28,46)6)65-41-38(35(58)32(55)26(20-51)64-41)66-39-36(59)33(56)30(53)24(18-49)62-39/h7,21,23-41,49-51,53-60H,8-20H2,1-6H3
InChIKey
InChIKey=LWMKKJBQNOLSBE-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=O)(C)C(OC7C(OC8OC(CO)C(O)C(O)C8O)C(O)C(O)C(CO)O7)CC6)CC(C)(C)CC3
Canonical SMILES
O=CC1(C)C(OC2OC(CO)C(O)C(O)C2OC3OC(CO)C(O)C(O)C3O)CCC4(C)C1CCC5(C)C4CC=C6C7CC(C)(C)CCC7(C(=O)OC8OC(CO)C(O)C(O)C8O)CCC65C
Other Names for this Substance
- Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-23-oxo-, β-D-glucopyranosyl ester, (3β,4α)-
- Lucyoside L