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CAS 114906-75-1

:

O-6-Deoxy-α-L-mannopyranosyl-(1→4)-O-6-O-acetyl-β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl (3β)-3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]olean-12-en-28-oate

Description:
O-6-Deoxy-α-L-mannopyranosyl-(1→4)-O-6-O-acetyl-β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl (3β)-3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]olean-12-en-28-oate, with CAS number 114906-75-1, is a complex glycosylated compound characterized by its intricate structure comprising multiple sugar moieties and an oleanolic acid derivative. This substance features a backbone of oleanolic acid, which is a pentacyclic triterpene, modified by various glycosidic linkages that contribute to its biological activity. The presence of deoxy sugars and acetyl groups suggests potential roles in biological processes, including interactions with cell membranes or modulation of biological pathways. Its structural complexity may also indicate potential applications in pharmaceuticals or as a natural product with therapeutic properties. The specific stereochemistry and glycosidic linkages are crucial for its functionality, influencing solubility, stability, and bioactivity. Overall, this compound exemplifies the diverse chemistry of natural products and their potential utility in medicinal chemistry and biochemistry.
Formula:C61H98O26
InChI:InChI=1S/C61H98O26/c1-25-36(64)40(68)44(72)51(80-25)85-48-32(24-77-27(3)62)83-50(47(75)43(48)71)79-23-31-39(67)42(70)46(74)53(82-31)87-55(76)61-19-17-56(4,5)21-29(61)28-11-12-34-58(8)15-14-35(57(6,7)33(58)13-16-60(34,10)59(28,9)18-20-61)84-54-49(38(66)30(63)22-78-54)86-52-45(73)41(69)37(65)26(2)81-52/h11,25-26,29-54,63-75H,12-24H2,1-10H3/t25-,26-,29-,30-,31+,32+,33-,34+,35-,36-,37-,38-,39+,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51-,52-,53-,54-,58-,59+,60+,61-/m0/s1
InChI key:InChIKey=RHHSFOQSESHVRS-WYRPNKAHSA-N
SMILES:C(O[C@@H]1O[C@H](CO[C@@H]2O[C@H](COC(C)=O)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)(=O)[C@]45[C@](C=6[C@@](C)(CC4)[C@@]7(C)[C@](CC6)([C@]8(C)[C@@](CC7)(C(C)(C)[C@@H](O[C@H]9[C@H](O[C@H]%10[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O%10)[C@@H](O)[C@@H](O)CO9)CC8)[H])[H])(CC(C)(C)CC5)[H]
Synonyms:
  • Ciwujianoside C4
  • O-6-Deoxy-α-L-mannopyranosyl-(1→4)-O-6-O-acetyl-β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl (3β)-3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]olean-12-en-28-oate
  • Olean-12-en-28-oic acid, 3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-, O-6-deoxy-α-L-mannopyranosyl-(1→4)-O-6-O-acetyl-β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl ester, (3β)-
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