CHEBI:226284 - SF2768 I

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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 SF2768 I
ChEBI ID CHEBI:226284
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C18H32N4O6
Net Charge 0
Average Mass 400.476
Monoisotopic Mass 400.23218
InChI InChI=1S/C18H32N4O6/c1-13(20-11-23)8-17(26)19-7-5-4-6-16(10-28-15(3)25)22-18(27)9-14(2)21-12-24/h11-14,16H,4-10H2,1-3H3,(H,19,26)(H,20,23)(H,21,24)(H,22,27)/t13-,14-,16+/m1/s1
InChIKey JUDJFBXUCNIELO-FMKPAKJESA-N
SMILES O=C(N[C@H](COC(=O)C)CCCCNC(=O)C[C@H](NC=O)C)C[C@H](NC=O)C
Metabolite of Species Details
Streptomyces thioluteus (NCBI:txid66431) See: PubMed
ChEBI Ontology
Outgoing SF2768 I (CHEBI:226284) has functional parent β-amino acid (CHEBI:33706)
SF2768 I (CHEBI:226284) is a organonitrogen compound (CHEBI:35352)
SF2768 I (CHEBI:226284) is a organooxygen compound (CHEBI:36963)
IUPAC Name
[(2S)-2,6-bis[[(3R)-3-ormamidobutanoyl]amino]hexyl] acetate