plastoquinone-9

Chemical Formula:

C₅₃H₈₀O₂

Molecular Weight:

749.214 Daltons

Monoisotopic Mass:

748.6158318122 Daltons

SMILES:

CC(C)=CCCC(=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(C)=CCCC(C)=CCC1(=CC(C(=C(C1=O)C)C)=O))C)C)C)C)C

InChI:

1S/C53H80O2/c1-40(2)21-13-22-41(3)23-14-24-42(4)25-15-26-43(5)27-16-28-44(6)29-17-30-45(7)31-18-32-46(8)33-19-34-47(9)35-20-36-48(10)37-38-51-39-52(54)49(11)50(12)53(51)55/h21,23,25,27,29,31,33,35,37,39H,13-20,22,24,26,28,30,32,34,36,38H2,1-12H3/b41-23+,42-25+,43-27+,44-29+,45-31+,46-33+,47-35+,48-37+

InChIKey:

FKUYMLZIRPABFK-IQSNHBBHSA-N

Databases

MetaCyc: PLASTOQUINONE-9

RefMet: Plastoquinone-9

HMDB: HMDB30130

ChemSpider: 4524723

ChEBI: 28377

PubChem (CID): 5375177

KEGG: C10385