input word = C00039265

Metabolite InformationStructural formula
Name Gibberosene A
(-)-Gibberosene A
Formula C22H32O4
Mw 360.23005951
CAS RN 1005397-90-9
C_ID C00039265 ,
InChIKey MVULDMBCESYPJZ-PTRLWAEKNA-N
InChICode InChI=1S/C22H32O4/c1-13(2)17-12-18-15(4)9-7-8-14(3)10-11-19-22(6,26-19)21(20(17)25-18)24-16(5)23/h8,12-13,15,19,21H,7,9-11H2,1-6H3/b14-8-/t15-,19+,21-,22+/m0/s1
SMILES [C@H]12CC/C(=C\CC[C@@H](c3cc(c([C@@H]([C@@]2(O1)C)OC(=O)C)o3)C(C)C)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Simularia gibberosa Ref.
--Sinularia gibberosa Ref.
zoom in