Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-14 22:43:31 UTC
Update Date2022-08-31 06:23:10 UTC
Metabolite IDMMDBc0004922
Metabolite Identification
Common NameSyringolin D
DescriptionSyringolin D belongs to the class of organic compounds known as cyclic peptides. Cyclic peptides are compounds containing a cyclic moiety bearing a peptide backbone. Based on a literature review very few articles have been published on Syringolin D.
Structure
SynonymsNot Available
Molecular FormulaC25H41N5O6
Average Mass507.632
Monoisotopic Mass507.30568406
IUPAC Name2-{[(1-{[(3Z,9Z)-2,7-dihydroxy-5-(propan-2-yl)-1,6-diazacyclododeca-1,3,6,9-tetraen-8-yl]-C-hydroxycarbonimidoyl}-2-methylpropyl)-C-hydroxycarbonimidoyl]amino}-3-methylpentanoic acid
Traditional Name2-{[(1-{[(3Z,9Z)-2,7-dihydroxy-5-isopropyl-1,6-diazacyclododeca-1,3,6,9-tetraen-8-yl]-C-hydroxycarbonimidoyl}-2-methylpropyl)-C-hydroxycarbonimidoyl]amino}-3-methylpentanoic acid
CAS Registry NumberNot Available
SMILES
[H]\C1=C([H])\C(N=C(O)C(N=C(O)NC(C(C)CC)C(O)=O)C(C)C)C(O)=NC(C(C)C)\C([H])=C([H])/C(O)=NCC1
InChI Identifier
InChI=1S/C25H41N5O6/c1-7-16(6)21(24(34)35)30-25(36)29-20(15(4)5)23(33)28-18-10-8-9-13-26-19(31)12-11-17(14(2)3)27-22(18)32/h8,10-12,14-18,20-21H,7,9,13H2,1-6H3,(H,26,31)(H,27,32)(H,28,33)(H,34,35)(H2,29,30,36)/b10-8-,12-11-
InChI KeyXQCDUALOSDLZKD-SIBMFBDYSA-N