input word = C00014937

Metabolite InformationStructural formula
Name Glycinocin B
Formula C58H92N12O19
Mw 1260.66016885
CAS RN 634564-83-3
C_ID C00014937 ,
InChIKey NYKOFOHQRGHCFZ-KVKQSBKUNA-N
InChICode InChI=1S/C58H92N12O19/c1-6-34(4)49-58(89)70-25-19-22-41(70)54(85)59-29-39(66-53(84)38(28-48(80)81)63-42(72)23-16-14-12-10-8-7-9-11-13-15-20-33(2)3)57(88)69-24-18-17-21-40(69)55(86)62-31-44(74)65-36(26-46(76)77)51(82)60-30-43(73)64-37(27-47(78)79)52(83)61-32-45(75)67-50(35(5)71)56(87)68-49/h16,23,33-41,49-50,71H,6-15,17-22,24-32H2,1-5H3,(H,59,85)(H,60,82)(H,61,83)(H,62,86)(H,63,72)(H,64,73)(H,65,74)(H,66,84)(H,67,75)(H,68,87)(H,76,77)(H,78,79)(H,80,81)/b23-16+/t34-,35+,36-,37-,38-,39-,40+,41-,49+,50+/m0/s1
SMILES N12C(=O)[C@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]3N(C(=O)[C@H](CNC(=O)[C@@H]1CCC2)NC(=O)[C@H](CC(=O)O)NC(=O)/C=C/CCCCCCCCCCC(C)C)CCCC3)CC(=O)O)CC(=O)O)[C@@H](C)O)[C@H](CC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Actinomycete sp. Ref.
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