input word = C00048747

Metabolite InformationStructural formula
Name Latrunculone A
(+)-Latrunculone A
Formula C22H31NO7S
Mw 453.18212308
CAS RN 1073607-06-3
C_ID C00048747 ,
InChIKey CAODWWDJZSOHTH-HBDIHRMJNA-N
InChICode InChI=1S/C22H31NO7S/c1-13-3-5-15(24)6-8-18(25)14(2)4-7-16-10-17(29-20(26)9-13)11-22(28,30-16)19-12-31-21(27)23-19/h6,8-9,14-17,19,24,28H,3-5,7,10-12H2,1-2H3,(H,23,27)/b8-6+,13-9-/t14-,15-,16+,17+,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=C/C(=O)[C@H](CC2)C)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