CHEBI:169292 - Dynorphin A (6-8)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Dynorphin A (6-8)
ChEBI ID CHEBI:169292
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H37N9O4
Net Charge 0
Average Mass 443.553
Monoisotopic Mass 443.29685
InChI InChI=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
InChIKey BHSYMWWMVRPCPA-FVCCEPFGSA-N
SMILES O=C(N[C@H]([C@@H](CC)C)C(O)=O)[C@@H](NC(=O)[C@H](N)CCCN=C(N)N)CCCN=C(N)N
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 Xrefs Databases
30776663 ChemSpider
HMDB0012932 HMDB
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