input word = C00041899

Metabolite InformationStructural formula
Name Stylisin 2
Formula C44H57N7O8
Mw 811.42686185
CAS RN 917249-87-7
C_ID C00041899 ,
InChIKey OKVPFWBESRTMEN-VSOLCASRNA-N
InChICode InChI=1S/C44H57N7O8/c1-3-27(2)37-44(59)50-23-9-14-34(50)39(54)46-32(26-29-17-19-30(52)20-18-29)42(57)51-24-10-16-36(51)43(58)49-22-8-13-33(49)38(53)45-31(25-28-11-5-4-6-12-28)41(56)48-21-7-15-35(48)40(55)47-37/h4-6,11-12,17-20,27,31-37,52H,3,7-10,13-16,21-26H2,1-2H3,(H,45,53)(H,46,54)(H,47,55)/t27-,31-,32-,33-,34-,35-,36-,37-/m0/s1
SMILES [C@@H]12N(C(=O)[C@H]3N(C(=O)[C@@H](NC(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@H]5N(C(=O)[C@@H](NC1=O)Cc1ccccc1)CCC5)[C@@H](C)CC)CCC4)Cc1ccc(cc1)O)CCC3)CCC2
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Asp
Organism
Kingdom Family Species Reference
--Stylissa caribica Ref.
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