input word = C00027697

Metabolite InformationStructural formula
Name 16-epi-Latrunculin B
Formula C20H29NO5S
Mw 395.17664377
CAS RN 444911-05-1
C_ID C00027697 ,
InChIKey NSHPHXHGRHSMIK-RWKMVSODNA-N
InChICode InChI=1S/C20H29NO5S/c1-13-5-3-4-6-14(2)9-18(22)25-16-10-15(8-7-13)26-20(24,11-16)17-12-27-19(23)21-17/h3,5,9,13,15-17,24H,4,6-8,10-12H2,1-2H3,(H,21,23)/b5-3-,14-9+/t13?,15-,16-,17-,20-/m1/s1
SMILES [C@H]1(/C=C\CC/C(=C/C(=O)O[C@@H]2C[C@@H](CC1)O[C@](C2)([C@H]1CSC(=O)N1)O)/C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
--Negombata magnifica Ref.
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OrganismNegombata magnifica
ReferenceHoya,J.Am.Chem.Soc.,124,(2002),7405