Cas no 1137673-11-0 (Triterpenoid-monoterpenoid saponins; Albizoside A)

Triterpenoid-monoterpenoid saponins; Albizoside A structure
1137673-11-0 structure
Product Name:Triterpenoid-monoterpenoid saponins; Albizoside A
CAS No:1137673-11-0
MF:C30H48O5
MW:488.699130058289
CID:6743637
Update Time:2024-03-03

Triterpenoid-monoterpenoid saponins; Albizoside A Chemical and Physical Properties

Names and Identifiers

    • Albizoside A
    • 21-O-{(2E,6S)-2-hydroxymethyl-6-methyl-6-O-{4-O-(2'E,6'S)-2',6'-dimethyl-6'-O-[2'-O-(2''E,6''S)-2''-hydroxymethyl-6''-methyl-6''-O-beta-D-quinovopyranosyl-2'',7''-octadienoyl-beta-D-quinovopyranosyl]-2',7'-octadienoyl-beta-D-quinovopyranosyl}-2,7-octadienoyl}-3-O-[beta-D-xylopyranosyl-(1->2)-beta-D-fucopyranosyl-(1->6)-beta-D-glucopyranosyl]acacic acid 28-O-beta-D-glucopyranosyl-(1->3)-[alpha-L-arabinofuranosyl-(1->4)]-alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranosyl ester
    • (-)-Albizoside A
    • Triterpenoid-monoterpenoid saponins; Albizoside A
    • Inchi: 1S/C30H48O5/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(31)26(3,4)19(27)10-13-28(20,6)29(17,7)15-23(33)30(18,24(34)35)16-22(25)32/h8,18-23,31-33H,9-16H2,1-7H3,(H,34,35)
    • InChI Key: CFKXWTNHIJAFNL-UHFFFAOYSA-N
    • SMILES: CC1(C(O)CC2(C(C3C(CC2O)(C)C2(C(C4(C(CC2)C(C)(C)C(O)CC4)C)CC=3)C)C1)C(=O)O)C

Computed Properties

  • Hydrogen Bond Donor Count: 29
  • Hydrogen Bond Acceptor Count: 56
  • Heavy Atom Count: 174
  • XLogP3: -0.911000000000002
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