input word = C00042815

Metabolite InformationStructural formula
Name Pacificin C
(-)-Pacificin C
Formula C20H34O4
Mw 338.24570957
CAS RN 847450-73-1
C_ID C00042815 ,
InChIKey QVXHUQXNTXETOI-DNGHGTMUNA-N
InChICode InChI=1S/C20H34O4/c1-17(2,24-22)8-6-9-18(3)11-12-20(5)16(23-20)7-10-19(4,21)15-13-14(15)18/h6,8,14-16,21-22H,7,9-13H2,1-5H3/b8-6+/t14-,15-,16-,18-,19-,20+/m0/s1
SMILES C1C[C@H]2[C@@](CC[C@@]([C@@H]3[C@@H]([C@@]1(C)O)C3)(C/C=C/C(C)(C)OO)C)(O2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Nephthea pacifica Ref.
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