input word = C00011271

Metabolite InformationStructural formula
Name 12,13-Dihydroaustamide
Formula C21H23N3O3
Mw 365.17394162
CAS RN 34506-79-1
C_ID C00011271 ,
InChIKey IBKVDWUJGBOZEF-IBSVAOPJNA-N
InChICode InChI=1S/C21H23N3O3/c1-20(2)9-11-24-16(19(27)23-10-5-8-15(23)18(24)26)12-21(20)17(25)13-6-3-4-7-14(13)22-21/h3-4,6-7,9,11,15-16,22H,5,8,10,12H2,1-2H3/t15-,16-,21+/m0/s1
SMILES c1c2c(ccc1)C(=O)[C@@]1(N2)C(C=CN2[C@@H](C1)C(=O)N1[C@H](C2=O)CCC1)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro IPP
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus ustus Ref.
FungiTrichocomaceaePenicillium italicum Ref.
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