input word = C00046917

Metabolite InformationStructural formula
Name Scleramide
Formula C38H45N7O7
Mw 711.33804684
CAS RN 287181-88-8
C_ID C00046917 ,
InChIKey UTVCBQCZOQNCAY-WGFYKNLNNA-N
InChICode InChI=1S/C38H45N7O7/c1-44-30(21-26-14-8-4-9-15-26)35(49)41-24-34(48)43-29(20-25-12-6-3-7-13-25)38(52)45(2)31(22-27-16-10-5-11-17-27)36(50)40-23-33(47)42-28(37(44)51)18-19-32(39)46/h3-17,28-31H,18-24H2,1-2H3,(H2,39,46)(H,40,50)(H,41,49)(H,42,47)(H,43,48)/t28-,29-,30-,31-/m0/s1
SMILES CN1C(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H]1Cc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp L-Phe L-His
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus sclerotiorum NRRL5167 Ref.
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