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CHEBI:169292 - Dynorphin A (6-8)

ChEBI IDCHEBI:169292
ChEBI NameDynorphin A (6-8)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H37N9O4
Net Charge0
Average Mass443.553
Monoisotopic Mass443.29685
SMILESCC[C@@H](C)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](N)CCCN=C(N)N)C(=O)O
InChIInChI=1S/C18H37N9O4/c1-3-10(2)13(16(30)31)27-15(29)12(7-5-9-25-18(22)23)26-14(28)11(19)6-4-8-24-17(20)21/h10-13H,3-9,19H2,1-2H3,(H,26,28)(H,27,29)(H,30,31)(H4,20,21,24)(H4,22,23,25)/t10-,11-,12+,13-/m1/s1
InChIKeyBHSYMWWMVRPCPA-FVCCEPFGSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Dynorphin A (6-8) (CHEBI:169292) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(2R,3R)-2-[[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoic acid
Manual XrefsDatabases
HMDB0012932HMDB
30776663ChemSpider