input word = C00018192

Metabolite InformationStructural formula
Name Ionomycin
Formula C41H72O9
Mw 708.5176339
CAS RN 56092-81-0
C_ID C00018192 ,
InChIKey PGHMRUGBZOYCAA-MGRIZGNQNA-N
InChICode InChI=1S/C41H72O9/c1-25(21-29(5)34(43)24-35(44)30(6)22-27(3)20-26(2)14-15-38(46)47)12-11-13-28(4)39(48)31(7)36(45)23-33-16-18-41(10,49-33)37-17-19-40(9,50-37)32(8)42/h11,13,24-33,36-37,39,42-43,45,48H,12,14-23H2,1-10H3,(H,46,47)/b13-11+,34-24-/t25-,26-,27+,28-,29-,30+,31+,32-,33+,36+,37-,39-,40+,41+/m1/s1
SMILES [C@@]1(CC[C@@H](O1)[C@]1(O[C@@H](CC1)C[C@@H]([C@@H]([C@@H]([C@@H](/C=C/C[C@H](C[C@H](/C(=C/C(=O)[C@H](C[C@H](C[C@@H](CCC(=O)O)C)C)C)/O)C)C)C)O)C)O)C)([C@@H](C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces conglobatus sp. nov. Ref.
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