Substance
  • Substance Name: abietic acid
  • Formula: C20H30O2
  • Molecular Weight: 302.5 g/mol
  • Identifiers:
    • inchi: InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1
    • inchikey: RSWGJHLUYNHPMX-ONCXSQPRSA-N
    • casrn: 514-10-3
    • csmiles: CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)O)C
    • ismiles: CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)O)C
    • pubchemId: 10569
    • iupacname: (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid
    • wikidataId: Q321068
    • chemspiderId: 10127
    • dsstoxcmpId: DTXCID202047
    • chemblId: CHEMBL71893
    • ecnumber: 208-178-3
abietic acid
Systems and Datasets