input word = C00041898

Metabolite InformationStructural formula
Name Stylisin 1
(-)-Stylisin 1
Formula C45H61N7O8
Mw 827.45816198
CAS RN 917249-86-6
C_ID C00041898 ,
InChIKey AZOCIRVHHHBKAS-GOSODLTDNA-N
InChICode InChI=1S/C45H61N7O8/c1-5-28(4)38-42(57)48-34(25-29-12-7-6-8-13-29)45(60)51-22-10-14-35(51)39(54)46-32(24-27(2)3)43(58)50-21-9-15-36(50)40(55)47-33(26-30-17-19-31(53)20-18-30)44(59)52-23-11-16-37(52)41(56)49-38/h6-8,12-13,17-20,27-28,32-38,53H,5,9-11,14-16,21-26H2,1-4H3,(H,46,54)(H,47,55)(H,48,57)(H,49,56)/t28-,32-,33-,34-,35-,36-,37-,38-/m0/s1
SMILES [C@@H]12N(C(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]4N(C(=O)[C@@H](NC1=O)Cc1ccc(cc1)O)CCC4)[C@@H](C)CC)Cc1ccccc1)CCC3)CC(C)C)CCC2
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Asp
Organism
Kingdom Family Species Reference
--Stylissa caribica Ref.
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OrganismStylissa caribica
ReferenceMohammed,J.Nat.Prod.,69,(2006),1739