input word = C00045915

Metabolite InformationStructural formula
Name Epothilone G2
(-)-Epothilone G2
Formula C27H41NO7
Mw 491.28830267
CAS RN 198571-00-5
C_ID C00045915 ,
InChIKey WFXWKMLJLRBVHH-LHMFBZSQNA-N
InChICode InChI=1S/C27H41NO7/c1-15-9-8-10-27(7)22(35-27)12-20(16(2)11-19-14-33-18(4)28-19)34-23(30)13-21(29)26(5,6)25(32)17(3)24(15)31/h11,14-15,17,20-22,24,29,31H,8-10,12-13H2,1-7H3/b16-11+/t15-,17+,20-,21-,22-,24+,27+/m0/s1
SMILES O1[C@@]2(CCC[C@@H]([C@H]([C@H](C(=O)C([C@H](CC(=O)O[C@@H](C[C@H]12)/C(=C/c1nc(oc1)C)/C)O)(C)C)C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro
Organism
Kingdom Family Species Reference
--Sorangium cellulosum Ref.
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