input word = C00045362

Metabolite InformationStructural formula
Name Phebaclavin A
Formula C16H16O6
Mw 304.09468824
CAS RN 416845-69-7
C_ID C00045362 ,
InChIKey KXEJCMRLSGMAAK-RUDMXATFSA-N
InChICode InChI=1S/C16H16O6/c1-9(15(18)21-3)4-5-11-8-10-6-7-12(20-2)13(17)14(10)22-16(11)19/h4,6-8,17H,5H2,1-3H3/b9-4+
SMILES c1(ccc2c(c1O)oc(=O)c(c2)C/C=C(/C(=O)OC)\C)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaePhebalium clavatum Ref.
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