Abieta-7,13-dien-18-oic acid - iron (1:1)
[CAS# 74356-11-9]

Identification

• Name: Abieta-7,13-dien-18-oic acid - iron (1:1)
• Synonyms: iron abietate
• Molecular Formula: C₂₀H₃₀FeO₂
• Molecular Weight: 358.30
• CAS Registry Number: 74356-11-9
• EINECS: 277-835-4
• SMILES: [Fe].CC(C)C\1=C\C2=C\C[C@H]3[C@@](C)(CCC[C@]3(C)[C@H]2CC/1)C(O)=O
• InChI: 1S/C20H30O2.Fe/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: MXIZDAHQPZOGMW-XTICBAGASA-N