input word = C00039227

Metabolite InformationStructural formula
Name Frajunolide K
(+)-Frajunolide K
Formula C31H41ClO11
Mw 624.23373986
CAS RN 1058643-50-7
C_ID C00039227 ,
InChIKey KRSRSVXCOOXXNY-KKDVFPBWNA-N
InChICode InChI=1S/C31H41ClO11/c1-9-15(2)28(36)39-14-23(35)42-22-13-11-17(4)25(32)27-31(38,18(5)29(37)43-27)26(41-20(7)34)24-16(3)10-12-21(30(22,24)8)40-19(6)33/h11,13,15,18,21-22,24-27,38H,3-4,9-10,12,14H2,1-2,5-8H3/b13-11+/t15-,18-,21-,22-,24+,25-,26-,27-,30?,31-/m0/s1
SMILES [C@@H]1(C(=C)/C=C/[C@@H]([C@@]2([C@@H]([C@@H]([C@@]3([C@H]1OC(=O)[C@@H]3C)O)OC(=O)C)C(=C)CC[C@@H]2OC(=O)C)C)OC(=O)COC(=O)[C@@H](C)CC)Cl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Junceella fragilis Ref.
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OrganismJunceella fragilis
ReferenceLiaw,J.Nat.Prod.,71,(2008),1551