input word = C00031600

Metabolite InformationStructural formula
Name Anthragallol 1,3-dimethyl ether
Formula C16H12O5
Mw 284.06847349
CAS RN 19852-76-7
C_ID C00031600 ,
InChIKey VVVZBZBYGDTROV-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O5/c1-20-11-7-10-12(16(21-2)15(11)19)14(18)9-6-4-3-5-8(9)13(10)17/h3-7,19H,1-2H3
SMILES c1(c(cc2c(c1OC)C(=O)c1c(C2=O)cccc1)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeMorinda citrifolia L. Ref.
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