input word = C00019929

Metabolite InformationStructural formula
Name 5'-Hydroxytriptiliocoumarin
Formula C25H30O4
Mw 394.21440945
CAS RN 118555-91-2
C_ID C00019929 ,
InChIKey HCOOKCZGEUCPPN-XGWYMTODNA-N
InChICode InChI=1S/C25H30O4/c1-7-24(6)15-25(27,14-17(4)11-8-10-16(2)3)29-22-20-18(5)12-9-13-19(20)28-23(26)21(22)24/h7,9-10,12-14,27H,1,8,11,15H2,2-6H3/b17-14+/t24-,25-/m0/s1
SMILES c1ccc2c(c1C)c1c(c(=O)o2)[C@@](C[C@](O1)(O)/C=C(/CCC=C(C)C)\C)(C)C=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTriptilion benaventei Ref.
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OrganismTriptilion benaventei
ReferenceBittner,Phytochem.,27,(1988),3263