input word = C00047907

Metabolite InformationStructural formula
Name Gracilin L
(+)-Gracilin L
Formula C23H34O6
Mw 406.23553882
CAS RN 1174022-27-5
C_ID C00047907 ,
InChIKey MHDUGZBUXWJHKW-NPBMAUEVNA-N
InChICode InChI=1S/C23H34O6/c1-7-15-16(23(6)10-8-9-22(4,5)12-23)11-17(26)19-18(15)20(27-13(2)24)29-21(19)28-14(3)25/h7,11,17-21,26H,8-10,12H2,1-6H3/b15-7+/t17-,18+,19-,20+,21-,23+/m1/s1
SMILES C1(=C[C@H]([C@@H]2[C@H](/C/1=C/C)[C@H](O[C@H]2OC(=O)C)OC(=O)C)O)[C@]1(CCCC(C1)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaDictyodendrillidaeSpongionella sp. Ref.
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OrganismSpongionella sp.
ReferenceRateb,J.Nat.Prod.,72,(2009),1471