input word = C00014896

Metabolite InformationStructural formula
Name Coniosetin
Formula C25H35NO4
Mw 413.25660861
CAS RN 436813-45-5
C_ID C00014896 ,
InChIKey ISHIUSZGAFLPLK-DTIYRWBDNA-N
InChICode InChI=1S/C25H35NO4/c1-6-7-8-9-18-15(3)13-17-12-14(2)10-11-19(17)25(18,5)23(29)20-22(28)21(16(4)27)26-24(20)30/h6-9,13-14,16-19,21,27,29H,10-12H2,1-5H3,(H,26,30)/b7-6+,9-8+,23-20+/t14-,16-,17-,18-,19-,21-,25+/m1/s1
SMILES [C@H]1(C(=C[C@@H]2[C@H]([C@]1(/C(=C/1\C(=O)[C@H](NC1=O)[C@H](O)C)/O)C)CC[C@H](C2)C)C)/C=C/C=C/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Coniochaeta ellipsoidea DSM 13856 Ref.
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OrganismConiochaeta ellipsoidea DSM 13856
ReferenceSegeth,J.Antibiotics 56,(2003),114