input word = C00045918

Metabolite InformationStructural formula
Name Epothilone K
(-)-Epothilone K
Formula C23H33NO4S
Mw 419.21302928
CAS RN 252917-55-8
C_ID C00045918 ,
InChIKey UYUFFQJDKXXQKP-TZFBCIAPNA-N
InChICode InChI=1S/C23H33NO4S/c1-14-7-6-8-15(2)23(27)17(4)20(25)12-22(26)28-21(10-9-14)16(3)11-19-13-29-18(5)24-19/h9,11,13,15,17,20-21,25H,6-8,10,12H2,1-5H3/b14-9-,16-11+/t15-,17-,20+,21+/m1/s1
SMILES C/C1=C/CC(/C(C)=C/c2csc(C)n2)OC(=O)C[C@H](O)C(C)C(=O)C(C)CCC1
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
--Sorangium cellulosum Ref.
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OrganismSorangium cellulosum
ReferenceHardt,J.Nat.Prod.,64,(2001),847