input word = C00015464

Metabolite InformationStructural formula
Name Antibiotic TMC 154
TMC 154
Formula C41H72O14
Mw 788.49220701
CAS RN 259258-94-1
C_ID C00015464 ,
InChIKey OBPQMRUXOXZBPH-GMNPXVIUNA-N
InChICode InChI=1S/C41H72O14/c1-12-21(2)13-22(3)14-27(8)38(55-41-37(50)36(49)39(52-11)32(19-43)54-41)28(9)16-25(6)33(46)23(4)15-24(5)34(47)26(7)17-29(10)40(51)53-20-31(45)35(48)30(44)18-42/h14-17,21-23,26,28,30-39,41-50H,12-13,18-20H2,1-11H3/b24-15+,25-16+,27-14+,29-17+/t21-,22-,23-,26-,28-,30+,31+,32+,33-,34+,35+,36+,37-,38+,39+,41+/m0/s1
SMILES [C@H]([C@H]([C@@H](COC(=O)/C(=C/[C@@H]([C@@H](/C(=C/[C@@H]([C@@H](/C(=C/[C@@H]([C@H](O[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)OC)O)O)/C(=C/[C@@H](C)C[C@@H](C)CC)/C)C)/C)O)C)/C)O)C)/C)O)O)(CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHypocreaceaeGliocladium sp. TC 1282 Ref.
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OrganismGliocladium sp. TC 1282
ReferenceKohno,J.Antibiotics 52,(1999),1114