Cas no 97763-17-2 (Jasmoside)

Jasmoside structure
Jasmoside structure
Product Name:Jasmoside
CAS No:97763-17-2
MF:C43H60O22
MW:928.923316001892
CID:1989463
PubChem ID:134714930
Update Time:2024-03-01

Jasmoside Chemical and Physical Properties

Names and Identifiers

    • Jasmoside
    • 9,12-Methano-3H,8H,14H-pyrano[3,4-c][1,7]dioxacyclododecin, 2H-pyran-4-acetic acid deriv. (ZCI)
    • 97763-17-2
    • Inchi: 1S/C43H60O22/c1-6-19-22(25(38(54)56-5)15-59-40(19)64-42-36(52)34(50)32(48)28(11-44)62-42)9-30(46)57-13-17(3)21-8-27-18(4)24(21)14-58-31(47)10-23-20(7-2)41(60-16-26(23)39(55)61-27)65-43-37(53)35(51)33(49)29(12-45)63-43/h6-7,15-18,21-24,27-29,32-37,40-45,48-53H,8-14H2,1-5H3/b19-6+,20-7+/t17?,18-,21+,22+,23+,24-,27-,28-,29-,32-,33-,34+,35+,36-,37-,40+,41+,42+,43+/m1/s1
    • InChI Key: GZBCQRQJJVIXDD-BKWVLOCKSA-N
    • SMILES: C(=C1/[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)OC=C2C(O[C@H]3[C@H](C)[C@@H](COC(C[C@@H]/12)=O)[C@H](C(C)COC(=O)C[C@@H]1C(C(=O)OC)=CO[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)/C/1=C/C)C3)=O)\C

Computed Properties

  • Exact Mass: 928.35762354g/mol
  • Monoisotopic Mass: 928.35762354g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 8
  • Hydrogen Bond Acceptor Count: 22
  • Heavy Atom Count: 65
  • Rotatable Bond Count: 14
  • Complexity: 1850
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 19
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.373000000000001
  • Topological Polar Surface Area: 322?2

Experimental Properties

  • Color/Form: Powder

Jasmoside Security Information

Jasmoside Pricemore >>

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