input word = C00013003

Metabolite InformationStructural formula
Name 1beta-Hydroxyarbusculin A
[3aS-(3aalpha,5abeta,6beta,9alpha,9aalpha,9bbeta)]-Decahydro-6,9-dihydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
Formula C15H22O4
Mw 266.15180919
CAS RN 50301-94-5
C_ID C00013003 ,
InChIKey LVABKRFKENTQBT-IOXXEBHFNA-N
InChICode InChI=1S/C15H22O4/c1-8-9-4-6-14(2)10(16)5-7-15(3,18)12(14)11(9)19-13(8)17/h9-12,16,18H,1,4-7H2,2-3H3/t9-,10+,11-,12+,14-,15+/m0/s1
SMILES [C@@H]1([C@]2([C@H]([C@](CC1)(C)O)[C@@H]1[C@@H](CC2)C(=C)C(=O)O1)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTanacetum vulgare Ref.
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OrganismTanacetum vulgare
ReferenceSamek,Collect.Czech.Chem.Commun.,38,(1973),1971