input word = C00036985

Metabolite InformationStructural formula
Name Cyclolinopeptide C
Formula C56H83N9O10S
Mw 1073.59836067
CAS RN 222527-65-3
C_ID C00036985 ,
InChIKey LQYNHLBOOQXJGZ-UHFFFAOYNA-N
InChICode InChI=1S/C56H83N9O10S/c1-10-34(6)45-53(71)57-39(27-30-76(9)75)48(66)61-46(35(7)11-2)54(72)63-47(36(8)12-3)56(74)65-29-20-26-43(65)55(73)64-28-19-25-42(64)51(69)59-40(31-37-21-15-13-16-22-37)49(67)58-41(32-38-23-17-14-18-24-38)50(68)60-44(33(4)5)52(70)62-45/h13-18,21-24,33-36,39-47H,10-12,19-20,25-32H2,1-9H3,(H,57,71)(H,58,67)(H,59,69)(H,60,68)(H,61,66)(H,62,70)(H,63,72)/t34-,35+,36-,39+,40-,41-,42+,43+,44-,45-,46-,47-,76-/m0/s1
SMILES N12[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3[C@@H](C1=O)CCC3)[C@H](CC)C)[C@H](C)CC)CC[S@@](=O)C)[C@@H](C)CC)C(C)C)Cc1ccccc1)Cc1ccccc1)CCC2
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeLinaceaeLinum usitatissimum Ref.
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