input word = C00039268

Metabolite InformationStructural formula
Name Gibberosene D
Formula C22H34O4
Mw 362.24570957
CAS RN 1005397-93-2
C_ID C00039268 ,
InChIKey HVKLCFQGBOCFBB-XMQGKRIDNA-N
InChICode InChI=1S/C22H34O4/c1-15(2)18-11-13-21(5,24)12-7-8-16(3)9-10-19-22(6,26-19)20(14-18)25-17(4)23/h8,11,13-15,19-20,24H,7,9-10,12H2,1-6H3/b13-11+,16-8+,18-14-/t19-,20-,21-,22+/m0/s1
SMILES CC(=O)O[C@H]1/C=C(C(C)C)/C=C/[C@@](C)(O)CC/C=C(C)CC[C@@H]2O[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Simularia gibberosa Ref.
--Sinularia gibberosa Ref.
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OrganismSimularia gibberosa
ReferenceAhmed,J.Nat.Prod.,71,(2008),179