O-6-Deoxy-α-L-mannopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-D-xylopyranosyl (3β,16α)-3-(β-D-glucopyranosyloxy)-16-hydroxyolean-12-en-28-oate
CAS Registry Number®
73039-13-1
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CAS Name
O-6-Deoxy-α-L-mannopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-D-xylopyranosyl (3β,16α)-3-(β-D-glucopyranosyloxy)-16-hydroxyolean-12-en-28-oateMolecular Formula
C58H94O25Molecular Mass
1191.35Cite this Page
O-6-Deoxy-α-L-mannopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-D-xylopyranosyl (3β,16α)-3-(β-D-glucopyranosyloxy)-16-hydroxyolean-12-en-28-oate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=73039-13-1 (retrieved ) (CAS RN: 73039-13-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C58H94O25/c1-23-34(63)37(66)40(69)48(76-23)81-45-28(61)22-74-47(43(45)72)80-44-24(2)77-49(42(71)39(44)68)82-46-35(64)27(60)21-75-51(46)83-52(73)58-17-16-53(3,4)18-26(58)25-10-11-31-55(7)14-13-33(79-50-41(70)38(67)36(65)29(20-59)78-50)54(5,6)30(55)12-15-56(31,8)57(25,9)19-32(58)62/h10,23-24,26-51,59-72H,11-22H2,1-9H3
InChIKey
InChIKey=IBEZGTWSSFFKNB-UHFFFAOYSA-N
SMILES
C(OC1C(OC2C(O)C(O)C(OC3C(O)C(OC4C(O)C(O)C(O)C(C)O4)C(O)CO3)C(C)O2)C(O)C(O)CO1)(=O)C56C(C=7C(C)(CC5O)C8(C)C(CC7)C9(C)C(CC8)C(C)(C)C(OC%10OC(CO)C(O)C(O)C%10O)CC9)CC(C)(C)CC6
Canonical SMILES
O=C(OC1OCC(O)C(O)C1OC2OC(C)C(OC3OCC(O)C(OC4OC(C)C(O)C(O)C4O)C3O)C(O)C2O)C56CCC(C)(C)CC6C7=CCC8C9(C)CCC(OC%10OC(CO)C(O)C(O)C%10O)C(C)(C)C9CCC8(C)C7(C)CC5O
Other Names for this Substance
- Olean-12-en-28-oic acid, 3-(β-D-glucopyranosyloxy)-16-hydroxy-, O-6-deoxy-α-L-mannopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-D-xylopyranosyl ester, (3β,16α)-
- O-6-Deoxy-α-L-mannopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-D-xylopyranosyl (3β,16α)-3-(β-D-glucopyranosyloxy)-16-hydroxyolean-12-en-28-oate
- Chrysantellin A
