Cas no 128533-05-1 (Gibbane-1,10-dicarboxylicacid, 3,7-dihydroxy-1,4a-dimethyl-8-methylene-, (1a,3b,4aa,4bb,10b)-)

Gibbane-1,10-dicarboxylicacid, 3,7-dihydroxy-1,4a-dimethyl-8-methylene-, (1a,3b,4aa,4bb,10b)- structure
128533-05-1 structure
Product Name:Gibbane-1,10-dicarboxylicacid, 3,7-dihydroxy-1,4a-dimethyl-8-methylene-, (1a,3b,4aa,4bb,10b)-
CAS No:128533-05-1
MF:C20H28O6
MW:364.433488608298
CID:161200
Update Time:2024-03-01

Gibbane-1,10-dicarboxylicacid, 3,7-dihydroxy-1,4a-dimethyl-8-methylene-, (1a,3b,4aa,4bb,10b)- Chemical and Physical Properties

Names and Identifiers

    • Gibbane-1,10-dicarboxylicacid, 3,7-dihydroxy-1,4a-dimethyl-8-methylene-, (1a,3b,4aa,4bb,10b)-
    • 1H-7,9a-Methanobenz[a]azulene,gibbane-1,10-dicarboxylic acid deriv.
    • GA97
    • Gibberellin A97
    • Inchi: 1S/C20H28O6/c1-10-6-19-9-20(10,26)5-4-12(19)17(2)7-11(21)8-18(3,16(24)25)14(17)13(19)15(22)23/h11-14,21,26H,1,4-9H2,2-3H3,(H,22,23)(H,24,25)/t11-,12-,13+,14-,17-,18+,19-,20-/m0/s1
    • InChI Key: DBFXNHHIIKEXPP-JOJUGDBLSA-N
    • SMILES: C([C@H]1[C@]2([H])[C@](C[C@@H](O)C[C@@]2(C)[C@]2([H])CC[C@@]3(O)C(=C)C[C@@]12C3)(C)C(=O)O)(=O)O

Computed Properties

  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 26
  • XLogP3: 0.603
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