input word = C00045906

Metabolite InformationStructural formula
Name Epothilone C5
(-)-Epothilone C5
Formula C26H37NO5S
Mw 475.23924403
CAS RN 252917-39-8
C_ID C00045906 ,
InChIKey MVIPGYRWGVEDHK-HJAOYLBMNA-N
InChICode InChI=1S/C26H37NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10-11,13,15,18,21-22,24,28,30H,7,9,12,14H2,1-6H3/b10-8-,16-11+,17-13+/t18-,21+,22+,24+/m1/s1
SMILES C/C(=Cc1csc(C)n1)[C@@H]1C/C=CCC/C=C(C)[C@H](O)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro
Organism
Kingdom Family Species Reference
--Sorangium cellulosum Ref.
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