CHEBI:222185 - Saccharochelin B

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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 Saccharochelin B
ChEBI ID CHEBI:222185
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H57N7O11
Net Charge 0
Average Mass 715.846
Monoisotopic Mass 715.41161
InChI InChI=1S/C32H57N7O11/c1-23(2)12-7-5-3-4-6-8-16-28(43)33-24(13-9-17-37(48)21-41)29(44)36-27(20-40)32(47)39(50)19-11-15-26-31(46)34-25(30(45)35-26)14-10-18-38(49)22-42/h21-27,40,48-50H,3-20H2,1-2H3,(H,33,43)(H,34,46)(H,35,45)(H,36,44)/t24-,25-,26-,27-/m0/s1
InChIKey LZVVUUWVABZKAU-FWEHEUNISA-N
SMILES O=C1N[C@H](C(=O)N[C@H]1CCCN(O)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCCCCCCCC(C)C)CCCN(O)C=O)CO)CCCN(O)C=O
Metabolite of Species Details
Saccharothrix (NCBI:txid2071) See: PubMed
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 Saccharochelin B (CHEBI:222185) is a dipeptide (CHEBI:46761)
IUPAC Name
N-[(2S)-5-[ormyl(hydroxy)amino]-1-[[(2S)-1-[3-[(2S,5S)-5-[3-[ormyl(hydroxy)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-hydroxyamino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxopentan-2-yl]-10-methylundecanamide