input word = C00040122

Metabolite InformationStructural formula
Name Pycnanthuquinone C
(+)-Pycnanthuquinone C
Formula C17H22O4
Mw 290.15180919
CAS RN 935537-80-7
C_ID C00040122 ,
InChIKey TZRVFRBFVXPYHU-VGYDIJHWNA-N
InChICode InChI=1S/C17H22O4/c1-8-7-10(18)13-11(14(8)19)15(20)12-9(16(13,2)3)5-6-17(12,4)21/h7,9,12,15,20-21H,5-6H2,1-4H3/t9-,12-,15+,17-/m1/s1
SMILES CC1=CC(=O)C2=C(C1=O)[C@H](O)[C@H]1[C@@H](CCC1(C)O)C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeCystophora harveyi Ref.
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