input word = C00042820

Metabolite InformationStructural formula
Name Pacificin H
(-)-Pacificin H
Formula C22H36O5
Mw 380.25627426
CAS RN 847450-78-6
C_ID C00042820 ,
InChIKey FAXDRDJWQDFFGZ-PRVZGDQTNA-N
InChICode InChI=1S/C22H36O5/c1-14(2)20(27-25)8-10-21(5)9-7-15(3)11-17(26-16(4)23)13-22(6,24)19-12-18(19)21/h11,17-20,24-25H,1,7-10,12-13H2,2-6H3/b15-11-/t17-,18-,19-,20-,21+,22-/m0/s1
SMILES [C@H]12[C@@H]([C@](CC/C(=C\[C@@H](C[C@]1(C)O)OC(=O)C)/C)(CC[C@@H](C(=C)C)OO)C)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Nephthea pacifica Ref.
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