input word = C00056645

Metabolite InformationStructural formula
Name 4'-Hydroxy-5,5'-diisopropyl-2,2'-dimethyl-3,4-biphenylquinone
Formula C20H24O3
Mw 312.17254463
CAS RN 120866-13-9
C_ID C00056645
InChIKey SFQOHOOISXSOPJ-UHFFFAOYSA-N
InChICode InChI=1S/C20H24O3/c1-10(2)14-8-16(12(5)7-18(14)21)17-9-15(11(3)4)20(23)19(22)13(17)6/h7-11,21H,1-6H3
SMILES CC1=C(c2cc(C(C)C)c(O)cc2C)C=C(C(C)C)C(=O)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeThymus vulgaris Ref.
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OrganismThymus vulgaris
ReferenceNakatani, N. et al., Agric. Biol. Chem., 1989, 53, 1375 (isol, pmr, cmr)