input word = C00011298

Metabolite InformationStructural formula
Name Fumitremorgin C
Formula C22H25N3O3
Mw 379.18959169
CAS RN 118974-02-0
C_ID C00011298 ,
InChIKey DBEYVIGIPJSTOR-GSECYGIDNA-N
InChICode InChI=1S/C22H25N3O3/c1-12(2)9-18-20-15(14-7-6-13(28-3)10-16(14)23-20)11-19-21(26)24-8-4-5-17(24)22(27)25(18)19/h6-7,9-10,17-19,23H,4-5,8,11H2,1-3H3/t17-,18-,19-/m0/s1
SMILES c1c2c(ccc1OC)c1c([nH]2)[C@@H](N2[C@@H](C1)C(=O)N1[C@H](C2=O)CCC1)C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus Ref.
FungiTrichocomaceaeAspergillus sydowi PFW1-13 Ref.
FungiTrichocomaceaeTalaromyces sp. LGT-2 Ref.
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