input word = C00051945

Metabolite InformationStructural formula
Name 13-Desoxy-terpendole I
Formula C27H35NO4
Mw 437.25660861
CAS RN
C_ID C00051945
InChIKey
InChICode InChI=1S/C27H35NO4/c1-24(2,30)22-20(29)23-27(32-23)18-10-9-14-13-16-15-7-5-6-8-17(15)28-21(16)26(14,4)25(18,3)12-11-19(27)31-22/h5-8,14,18-20,22-23,28-30H,9-13H2,1-4H3/t14-,18+,19-,20+,22-,23+,25-,26+,27-/m0/s1
SMILES c1cccc2c1[nH]c1c2C[C@H]2[C@]1([C@@]1([C@@H](CC2)[C@]23[C@H](CC1)O[C@@H]([C@H]([C@H]2O3)O)C(C)(C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiClavicipitaceaeEpichloe festucae Fg1 Ref.
FungiClavicipitaceaeEpichloe festucae Fl1 Ref.
--Chaunopycnis alba Ref.
--Epicholoe festucae Ref.
--Neotyphodium coenophialum Tf28 Ref.
--Neotyphodium coenophialum e822 Ref.
--Neotyphodium festucae Frc7 Ref.
--Neotyphodium funkii e4096 Ref.
--Neotyphodium lolii AR1 Ref.
--Neotyphodium lolii Lp14 Ref.
--Neotyphodium lolii Lp19 Ref.
--Neotyphodium siegelii e915 Ref.
--Neotyphodium tembladerae e1169 Ref.
--Neotyphodium tembladerae e4055 Ref.
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