input word = C00016007

Metabolite InformationStructural formula
Name Glisoprenin E
Formula C45H86O9
Mw 770.62718434
CAS RN 205594-90-7
C_ID C00016007 ,
InChIKey FXTQBFBSROLPRX-CRLNPPKONA-N
InChICode InChI=1S/C45H86O9/c1-35(17-11-18-36(2)20-13-32-45(10,54)39(48)22-21-37(3)24-34-46)19-12-25-41(6,50)26-14-27-42(7,51)28-15-29-43(8,52)30-16-31-44(9,53)33-23-38(47)40(4,5)49/h17,20,24,38-39,46-54H,11-16,18-19,21-23,25-34H2,1-10H3/b35-17+,36-20+,37-24+/t38-,39+,41-,42+,43-,44+,45+/m0/s1
SMILES C([C@H](CC[C@](CCC[C@@](CCC[C@](CCC[C@@](CCC/C(=C/CC/C(=C/CC[C@]([C@@H](CC/C(=C/CO)/C)O)(O)C)/C)/C)(C)O)(C)O)(C)O)(C)O)O)(O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHypocreaceaeGliocladium roseum HA190-95 Ref.
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OrganismGliocladium roseum HA190-95
ReferenceThines,J.Antibiotics 51,(1998),117