input word = C00048580

Metabolite InformationStructural formula
Name 18-epi-Latrunculol
(+)-18-epi-Latrunculol
Formula C22H33NO7S
Mw 455.19777315
CAS RN 1073607-04-1
C_ID C00048580 ,
InChIKey JIGPCDTWTJZFFF-IXIQQIQFNA-N
InChICode InChI=1S/C22H33NO7S/c1-13-3-6-15-10-16(11-22(28,30-15)19-12-31-21(27)23-19)29-20(26)9-14(2)5-8-18(25)17(24)7-4-13/h4,7,9,13,15-19,24-25,28H,3,5-6,8,10-12H2,1-2H3,(H,23,27)/b7-4+,14-9-/t13-,15+,16+,17-,18-,19+,22+/m0/s1
SMILES O1[C@H]2C[C@H](C[C@@]1([C@@H]1NC(=O)SC1)O)OC(=O)/C=C(\CC[C@@H]([C@H](/C=C/[C@H](CC2)C)O)O)/C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
--Cacospongia mycofijiensis Ref.
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OrganismCacospongia mycofijiensis
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165