EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:207376 - Versicotide D

ChEBI IDCHEBI:207376
ChEBI NameVersicotide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H22N4O4
Net Charge0
Average Mass418.453
Monoisotopic Mass418.16411
SMILESC[C@@H]1NC(=O)[C@@H]2Cc3ccccc3N2C(=O)CNC(=O)[C@H]2Cc3ccccc3N2C1=O
InChIInChI=1S/C23H22N4O4/c1-13-23(31)27-17-9-5-3-7-15(17)10-18(27)21(29)24-12-20(28)26-16-8-4-2-6-14(16)11-19(26)22(30)25-13/h2-9,13,18-19H,10-12H2,1H3,(H,24,29)(H,25,30)/t13-,18+,19-/m0/s1
InChIKeyQGAQNBBMPPLZJS-BKTGTZMESA-N
Species of MetaboliteComponentSourceComments
Aspergillus versicolor (ncbitaxon:46472) - DOI (10.1039/c7ra07940k)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Versicotide D (CHEBI:207376) is a cyclic peptide (CHEBI:23449)
IUPAC Name 
(1S,4S,14R)-4-methyl-3,6,16,19-tetrazapentacyclo[17.7.0.06,14.07,12.020,25]hexacosa-7,9,11,20,22,24-hexaene-2,5,15,18-tetrone
Manual XrefsDatabases
62453209ChemSpider