input word = C00013528

Metabolite InformationStructural formula
Name Geranioloxyalatum flavone
3,5-Dihydroxy-2-[3-hydroxy-4-[(7-hydroxy-3,7-dimethyloctyl)oxy]phenyl]-6,7-dimethoxy-4H-1-benzopyran-4-one
Formula C27H34O9
Mw 502.22028269
CAS RN 252351-60-3
C_ID C00013528 ,
InChIKey XLUWWEZLAOLITG-UHFFFAOYNA-N
InChICode InChI=1S/C27H34O9/c1-15(7-6-11-27(2,3)32)10-12-35-18-9-8-16(13-17(18)28)25-24(31)22(29)21-19(36-25)14-20(33-4)26(34-5)23(21)30/h8-9,13-15,28,30-32H,6-7,10-12H2,1-5H3/t15-/m1/s1
SMILES c12c(oc(c(c1=O)O)c1cc(c(cc1)OCC[C@H](C)CCCC(O)(C)C)O)cc(c(c2O)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeZanthoxylum alatum Ref.
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OrganismZanthoxylum alatum
ReferenceRamidi,Pharmazie,54,(1999),781