input word = C00055692

Metabolite InformationStructural formula
Name 5,6-dihydroxy-2-methoxy-7-phenylphenalen-1-one
Formula C20H14O4
Mw 318.08920894
CAS RN 42495-62-5
C_ID C00055692
InChIKey DCZSXXOUFZGESF-UHFFFAOYSA-N
InChICode InChI=1S/C20H14O4/c1-24-16-10-12-9-15(21)19(22)14-8-7-13(11-5-3-2-4-6-11)18(17(12)14)20(16)23/h2-10,21,23H,1H3
SMILES COc1cc2c3c(ccc(-c4ccccc4)c3c1O)C(=O)C(O)=C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHaemodoraceaeXiphidium caeruleum Ref.
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OrganismXiphidium caeruleum
ReferenceChen, Y. et al., Phytochemistry, 133, (2017), 15-25.