input word = C00013102

Metabolite InformationStructural formula
Name [1aS-(1aalpha,3aalpha,6alpha,8aalpha,8balpha)]-Octahydro-3a,7,7,8b-tetramethyl-2H-6,8a-methanooxireno[i][1]benzoxepin
Formula C15H24O2
Mw 236.17763001
CAS RN 60064-95-1
C_ID C00013102 ,
InChIKey SMVQLPPNRFDHMB-AMXVMDIFNA-N
InChICode InChI=1S/C15H24O2/c1-12(2)10-5-7-13(3)8-6-11-14(4,16-11)15(13,9-10)17-12/h10-11H,5-9H2,1-4H3/t10-,11+,13-,14+,15-/m1/s1
SMILES CC1(C)O[C@]23C[C@H]1CC[C@]2(C)CC[C@@H]1O[C@@]13C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeAlpinia japonica Ref.
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OrganismAlpinia japonica
ReferenceMaheshwari,Tetrahedron,19,(1963),1077

Thomas,Tetrahedron Lett.,(1976),1717

Itokawa,Chem.Pharm.Bull.,28,(1980),681