input word = C00003376

Metabolite InformationStructural formula
Name Tomentosin
Xanthalongin
Formula C15H20O3
Mw 248.1412445
CAS RN 33649-15-9
C_ID C00003376 ,
InChIKey AVFIYMSJDDGDBQ-ZQWJIHNYNA-N
InChICode InChI=1S/C15H20O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h6,9,13-14H,3-5,7-8H2,1-2H3/t9-,13+,14+/m0/s1
SMILES C=C1C(=O)O[C@@H]2C[C@H](C)C(CCC(C)=O)=CC[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeMarsdenia tomentosa Decne. Ref.
PlantaeAsteraceaeDittrichia graveolens (L.) GREUTER Ref.
PlantaeAsteraceaeInula helenium Ref.
PlantaeAsteraceaeInula japonica Ref.
PlantaeAsteraceaeParthenium tomentosum Ref.
PlantaeFagaceaeCastanea mollissima Ref.
PlantaeMyrtaceaeRhodomyrtus tomentosa Ref.
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OrganismInula japonica
ReferenceLiu, et al., NPRD, 10, (1998), 14.

Chinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999)