input word = C00013058

Metabolite InformationStructural formula
Name Herbolide G
[3S-(3alpha,3aalpha,5beta,5abeta,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-5-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one
Formula C15H22O3
Mw 250.15689457
CAS RN 97669-46-0
C_ID C00013058 ,
InChIKey AFZHVVHYFIWSIN-SQCUXGJQNA-N
InChICode InChI=1S/C15H22O3/c1-8-5-4-6-15(3)11(16)7-10-9(2)14(17)18-13(10)12(8)15/h5,9-13,16H,4,6-7H2,1-3H3/t9-,10-,11-,12+,13-,15+/m0/s1
SMILES CC1=CCC[C@@]2(C)[C@H]1[C@H]1OC(=O)[C@@H](C)[C@@H]1C[C@@H]2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia herba-alba Ref.
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OrganismArtemisia herba-alba
ReferenceSegal,Phytochem.,24,81985),1381