input word = C00018846

Metabolite InformationStructural formula
Name Pepstatin C
Formula C35H65N5O9
Mw 699.47822871
CAS RN 38752-30-6
C_ID C00018846 ,
InChIKey JOKUGRFMJJOCQE-UHFFFAOYNA-N
InChICode InChI=1S/C35H65N5O9/c1-18(2)12-13-28(43)39-31(21(7)8)35(49)40-32(22(9)10)34(48)38-24(14-19(3)4)26(41)16-29(44)36-23(11)33(47)37-25(15-20(5)6)27(42)17-30(45)46/h18-27,31-32,41-42H,12-17H2,1-11H3,(H,36,44)(H,37,47)(H,38,48)(H,39,43)(H,40,49)(H,45,46)/t23-,24+,25-,26-,27+,31-,32-/m1/s1
SMILES C(=O)(C[C@@H](O)[C@H](CC(C)C)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](C(C)C)NC(=O)CCC(C)C)N[C@H](C)C(=O)N[C@H](CC(C)C)[C@@H](O)CC(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces testaceus Ref.
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OrganismStreptomyces testaceus
ReferenceMiyano,J. Antibiotics 25,(1972),489