Thermoplasmaquinone
[CAS# 97858-30-5]

Identification

• Name: Thermoplasmaquinone
• Synonyms: 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-Heptamethyloctacosa-2,6,10,14,18,22,26-Heptaenyl]-3,5-Dimethyl-Naphthalene-1,4-Dione; 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-Heptamethyloctacosa-2,6,10,14,18,22,26-Heptaenyl]-3,5-Dimethyl-1,4-Naphthoquin
• Molecular Formula: C₄₇H₆₆O₂
• Molecular Weight: 663.04
• CAS Registry Number: 97858-30-5
• SMILES: C1=CC=C(C2=C1C(=O)C(=C(C2=O)C)C\C=C(\CC\C=C(\CC\C=C(\CC/C=C(/CC/C=C(/CC/C=C(/CCC=C(C)C)C)C)C)C)C)C)C
• InChI: 1S/C47H66O2/c1-34(2)18-11-19-35(3)20-12-21-36(4)22-13-23-37(5)24-14-25-38(6)26-15-27-39(7)28-16-29-40(8)32-33-43-42(10)46(48)45-41(9)30-17-31-44(45)47(43)49/h17-18,20,22,24,26,28,30-32H,11-16,19,21,23,25,27,29,33H2,1-10H3/b35-20+,36-22+,37-24+,38-26+,39-2
• InChIKey: PSTBTGWGIRVMGP-LJWNYQGCSA-N