α-L-Arabinopyranoside, (3β,4β,22β)-22,23-dihydroxyolean-12-en-3-yl O-α-L-arabinopyranosyl-(1→3)-O-[6-deoxy-α-L-mannopyranosyl-(1→2)]-O-β-D-galactopyranosyl-(1→2)-
CAS Registry Number®
CAS Name
α-L-Arabinopyranoside, (3β,4β,22β)-22,23-dihydroxyolean-12-en-3-yl O-α-L-arabinopyranosyl-(1→3)-O-[6-deoxy-α-L-mannopyranosyl-(1→2)]-O-β-D-galactopyranosyl-(1→2)-Molecular Formula
C52H86O20Molecular Mass
1031.23Cite this Page
α-L-Arabinopyranoside, (3β,4β,22β)-22,23-dihydroxyolean-12-en-3-yl O-α-L-arabinopyranosyl-(1→3)-O-[6-deoxy-α-L-mannopyranosyl-(1→2)]-O-β-D-galactopyranosyl-(1→2)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=172659-13-1 (retrieved ) (CAS RN: 172659-13-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C52H86O20/c1-23-33(58)37(62)39(64)44(67-23)72-42-40(70-43-38(63)34(59)26(55)20-65-43)36(61)28(19-53)68-46(42)71-41-35(60)27(56)21-66-45(41)69-32-12-13-49(5)29(50(32,6)22-54)11-14-52(8)30(49)10-9-24-25-17-47(2,3)18-31(57)48(25,4)15-16-51(24,52)7/h9,23,25-46,53-64H,10-22H2,1-8H3/t23-,25-,26-,27-,28+,29+,30+,31+,32-,33-,34-,35-,36-,37+,38+,39+,40-,41+,42+,43-,44-,45-,46-,48+,49-,50+,51+,52+/m0/s1
InChIKey
InChIKey=MKFBJAPUHISATM-SOGNSPOQSA-N
SMILES
C[C@]12[C@@]3(C)C([C@]4([C@@](C)(CC3)[C@H](O)CC(C)(C)C4)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)([C@](CO)(C)[C@@H](O[C@H]6[C@H](O[C@H]7[C@H](O[C@H]8[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O8)[C@@H](O[C@H]9[C@H](O)[C@@H](O)[C@@H](O)CO9)[C@@H](O)[C@@H](CO)O7)[C@@H](O)[C@@H](O)CO6)CC5)[H])[H]
Canonical SMILES
OCC1OC(OC2C(O)C(O)COC2OC3CCC4(C)C(CCC5(C)C4CC=C6C7CC(C)(C)CC(O)C7(C)CCC65C)C3(C)CO)C(OC8OC(C)C(O)C(O)C8O)C(OC9OCC(O)C(O)C9O)C1O
Other Names for this Substance
- α-L-Arabinopyranoside, (3β,4β,22β)-22,23-dihydroxyolean-12-en-3-yl O-α-L-arabinopyranosyl-(1→3)-O-[6-deoxy-α-L-mannopyranosyl-(1→2)]-O-β-D-galactopyranosyl-(1→2)-
- Melilotoside D
