Cas no 144077-05-4 (Olean-12-en-28-oicacid, 3-[(O-b-D-glucopyranosyl-(1®3)-O-[b-D-glucopyranosyl-(1®4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)-)

Olean-12-en-28-oicacid, 3-[(O-b-D-glucopyranosyl-(1®3)-O-[b-D-glucopyranosyl-(1®4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)- structure
144077-05-4 structure
Product Name:Olean-12-en-28-oicacid, 3-[(O-b-D-glucopyranosyl-(1®3)-O-[b-D-glucopyranosyl-(1®4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)-
CAS No:144077-05-4
MF:C54H88O23
MW:1105.26274013519
CID:161214
PubChem ID:3083390
Update Time:2025-04-19

Olean-12-en-28-oicacid, 3-[(O-b-D-glucopyranosyl-(1®3)-O-[b-D-glucopyranosyl-(1®4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)- Chemical and Physical Properties

Names and Identifiers

    • [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet
    • [(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6a S,6aS,6bR,10S,12aS,14bS)-10-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymeth yl)-3,4-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2 -yl]oxy]oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8 a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
    • 4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)-
    • araloside G
    • 3-O-beta-D-Glucopyranosyl(1-3)(beta-D-glucopyranosyl(1-4))-beta-D-glucopyranosyl-oleanolic acid-28-O-beta-D-glucopyranoside
    • 340963-86-2
    • Olean-12-en-28-oic-acid, 3-((O-beta-D-glucopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-4))-beta-D-glucopyranosyl)oxy)-, beta-D-glucopyranosyl ester, (3beta)-
    • [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-hepta
    • [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
    • Olean-12-en-28-oic acid, 3-((O-beta-D-glucopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-4))-beta-D-glucopyranosyl)oxy)-, beta-D-glucopyranosyl ester, (3beta)-
    • 144077-05-4
    • Congmunoside V
    • beta-D-Glucopyranosyl (3beta)-3-[(O-beta-D-glucopyranosyl-(1-->3)-O-[beta-D-glucopyranosyl-(1-->4)]-beta-D-glucopyranosyl)oxy]olean-12-en-28-oate
    • DTXSID601103358
    • Olean-12-en-28-oicacid, 3-[(O-b-D-glucopyranosyl-(1®3)-O-[b-D-glucopyranosyl-(1®4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)-
    • Inchi： 1S/C54H88O23/c1-49(2)14-16-54(48(69)77-46-41(68)38(65)34(61)27(21-57)72-46)17-15-52(6)23(24(54)18-49)8-9-30-51(5)12-11-31(50(3,4)29(51)10-13-53(30,52)7)74-47-43(76-45-40(67)37(64)33(60)26(20-56)71-45)42(35(62)28(22-58)73-47)75-44-39(66)36(63)32(59)25(19-55)70-44/h8,24-47,55-68H,9-22H2,1-7H3/t24-,25-,26-,27-,28-,29?,30-,31+,32-,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,43-,44+,45+,46+,47+,51+,52-,53-,54+/m1/s1
    • InChI Key： MROYUZKXUGPCPD-FMGADNLDSA-N
    • SMILES： O([C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)[C@H]1CC[C@@]2(C)C(CC[C@@]3(C)[C@]4(C)CC[C@@]5(C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@@H](CO)O6)O)O)O)CCC(C)(C)C[C@@H]5C4=CC[C@@H]32)C1(C)C

Computed Properties

  • Exact Mass: 1104.57163905g/mol
  • Monoisotopic Mass: 1104.57163905g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 14
  • Hydrogen Bond Acceptor Count: 23
  • Heavy Atom Count: 77
  • Rotatable Bond Count: 13
  • Complexity: 2110
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 27
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 374?2

Olean-12-en-28-oicacid, 3-[(O-b-D-glucopyranosyl-(1®3)-O-[b-D-glucopyranosyl-(1®4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)- Related Literature

Related Categories

144077-05-4 (Olean-12-en-28-oicacid, 3-[(O-b-D-glucopyranosyl-(1®3)-O-[b-D-glucopyranosyl-(1®4)]-b-D-glucopyranosyl)oxy]-, b-D-glucopyranosyl ester, (3b)-) Related Products

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