Cas no 74749-74-9 (Ginsenosides)

Ginsenosides structure
Ginsenosides structure
Product Name:Ginsenosides
CAS No:74749-74-9
MF:C30H52O2
MW:444.732689857483
CID:573339
PubChem ID:3086007
Update Time:2025-04-19

Ginsenosides Chemical and Physical Properties

Names and Identifiers

    • Ginsenosides
    • (3S,5R,8R,9R,10R,14R,17S)-17-(2-hydroxy-6-methylhept-5-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
    • GINSENOSIDE
    • 74749-74-9
    • 3K198YD54P
    • UNII-3K198YD54P
    • DB14152
    • Panaxosides
    • Inchi: 1S/C30H52O2/c1-20(2)10-9-16-30(8,32)22-13-18-28(6)21(22)11-12-24-27(5)17-15-25(31)26(3,4)23(27)14-19-29(24,28)7/h10,21-25,31-32H,9,11-19H2,1-8H3/t21?,22-,23-,24+,25-,27-,28+,29+,30?/m0/s1
    • InChI Key: NLHQJXWYMZLQJY-SWIZOJJJSA-N
    • SMILES: O[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@]1(C)[C@@H]2CCC2[C@@H](C(C)(CC/C=C(\C)/C)O)CC[C@@]12C

Computed Properties

  • Exact Mass: 444.396730897g/mol
  • Monoisotopic Mass: 444.396730897g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 4
  • Complexity: 750
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 7
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 8.5
  • Topological Polar Surface Area: 40.5?2
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