input word = C00012909

Metabolite InformationStructural formula
Name [3S-(3alpha,3abeta,4abeta,8aalpha,9abeta)]-Decahydro-3a-hydroperoxy-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Formula C15H22O4
Mw 266.15180919
CAS RN 129385-70-2
C_ID C00012909 ,
InChIKey VLCHYVSJZMSSLR-XKDVZGRHNA-N
InChICode InChI=1S/C15H22O4/c1-9-5-4-6-14(3)8-12-15(19-17,7-11(9)14)10(2)13(16)18-12/h10-12,17H,1,4-8H2,2-3H3/t10-,11+,12-,14-,15+/m1/s1
SMILES C1(=C)[C@H]2[C@](CCC1)(C[C@@H]1[C@](C2)([C@@H](C(=O)O1)C)OO)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeInula racemosa Ref.
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OrganismInula racemosa
ReferenceGoyal,Phytochem.,29,(1990),2341