input word = C00011774

Metabolite InformationStructural formula
Name [3S-(3R*,3aS*,4R*,7S*,10E,11aS*)]-3a,4,5,6,7,8,9,11a-octahydro-7-hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylene-Cyclodeca[b]furan-2(3H)-one
Formula C15H22O5
Mw 282.14672381
CAS RN 125675-21-0
C_ID C00011774 ,
InChIKey LWSOHBJCUUXYPK-QGHUTDKQNA-N
InChICode InChI=1S/C15H22O5/c1-8-4-5-12(20-18)9(2)7-11(16)14-10(3)15(17)19-13(14)6-8/h6,10-14,16,18H,2,4-5,7H2,1,3H3/b8-6+/t10-,11-,12+,13-,14+/m0/s1
SMILES C1(=C)C[C@@H]([C@@H]2[C@H](/C=C(/CC[C@H]1OO)\C)OC(=O)[C@H]2C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia herba-alba Ref.
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