input word = C00042813

Metabolite InformationStructural formula
Name Pacificin A
(-)-Pacificin A
Formula C20H34O2
Mw 306.25588033
CAS RN 847450-71-9
C_ID C00042813 ,
InChIKey TVFOQOGYYBMWNB-JJFZPGNJNA-N
InChICode InChI=1S/C20H34O2/c1-14(2)7-6-9-18(3)11-12-20(5)17(22-20)8-10-19(4,21)16-13-15(16)18/h7,15-17,21H,6,8-13H2,1-5H3/t15-,16-,17-,18-,19-,20+/m0/s1
SMILES C1C[C@H]2[C@@](CC[C@@]([C@@H]3[C@@H]([C@@]1(C)O)C3)(CCC=C(C)C)C)(O2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Nephthea pacifica Ref.
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