input word = C00047514

Metabolite InformationStructural formula
Name Micropeptin D
(-)-Micropeptin D
Formula C55H73N7O14
Mw 1055.52155009
CAS RN 1137584-38-3
C_ID C00047514 ,
InChIKey UYWDIVWVEOWICI-RNCIKCBENA-N
InChICode InChI=1S/C55H73N7O14/c1-6-7-8-9-13-16-44(65)56-39(26-28-46(67)68)49(69)60-48-33(4)76-55(75)47(32(2)3)59-51(71)42(30-36-19-23-38(64)24-20-36)61(5)54(74)43(31-34-14-11-10-12-15-34)62-45(66)27-25-40(53(62)73)57-50(70)41(58-52(48)72)29-35-17-21-37(63)22-18-35/h10-12,14-15,17-24,32-33,39-43,45,47-48,63-64,66H,6-9,13,16,25-31H2,1-5H3,(H,56,65)(H,57,70)(H,58,72)(H,59,71)(H,60,69)(H,67,68)/t33-,39+,40+,41+,42+,43+,45-,47+,48+/m1/s1
SMILES [C@H]1(CC[C@@H]2NC(=O)[C@@H](NC(=O)[C@H]([C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N1C2=O)Cc1ccccc1)C)Cc1ccc(cc1)O)C(C)C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCCCCCC)Cc1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
--Microcystis aeruginosa Ref.
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