input word = C00007125

Metabolite InformationStructural formula
Name Xanthoangelol B
Formula C25H28O5
Mw 408.193674
CAS RN 132998-81-3
C_ID C00007125 ,
InChIKey NCHZAFAGBAEJJJ-BAYITLGHNA-N
InChICode InChI=1S/C25H28O5/c1-16(2)22(27)13-5-17(3)4-11-20-24(29)15-12-21(25(20)30)23(28)14-8-18-6-9-19(26)10-7-18/h4,6-10,12,14-15,22,26-27,29-30H,1,5,11,13H2,2-3H3/b14-8+,17-4+/t22-/m0/s1
SMILES C=C(C)C(O)CC/C(C)=C/Cc1c(O)ccc(C(=O)/C=C/c2ccc(O)cc2)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica keiskei Ref.
PlantaeMoraceaeArtocarpus nobilis Ref.
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