input word = C00012853

Metabolite InformationStructural formula
Name Isocorymbolone
[4R-(4a,4aa,6b,8a,8ab)]-Octahydro-8-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone
Formula C15H24O2
Mw 236.17763001
CAS RN 99933-34-3
C_ID C00012853 ,
InChIKey SIMDYOBAKHHYEQ-QIDKGPDZNA-N
InChICode InChI=1S/C15H24O2/c1-9(2)11-7-12-10(3)5-6-13(16)15(12,4)14(17)8-11/h10-12,14,17H,1,5-8H2,2-4H3/t10-,11+,12+,14-,15-/m1/s1
SMILES [C@@H]1([C@H]2[C@](C(=O)CC1)([C@@H](C[C@H](C2)C(=C)C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCyperus corymbosus Ref.
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