CHEBI:224124 - Chetocochliodin F

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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 Chetocochliodin F
ChEBI ID CHEBI:224124
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H19N3O5
Net Charge 0
Average Mass 333.344
Monoisotopic Mass 333.13247
InChI InChI=1S/C16H19N3O5/c1-23-15(7-10-8-17-12-6-4-3-5-11(10)12)13(21)19-16(9-20,24-2)14(22)18-15/h3-6,8,17,20H,7,9H2,1-2H3,(H,18,22)(H,19,21)/t15-,16-/m0/s1
InChIKey VJCAXVTUQNMMKK-HOTGVXAUSA-N
SMILES O=C1N[C@@](OC)(C(=O)N[C@]1(OC)CO)CC=2C3=C(C=CC=C3)NC2
Metabolite of Species Details
Chaetomium cochliodes (NCBI:txid904709) See: PubMed
ChEBI Ontology
Outgoing Chetocochliodin F (CHEBI:224124) has functional parent α-amino acid (CHEBI:33704)
Chetocochliodin F (CHEBI:224124) is a organonitrogen compound (CHEBI:35352)
Chetocochliodin F (CHEBI:224124) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(3S,6S)-3-(hydroxymethyl)-6-(1H-indol-3-ylmethyl)-3,6-dimethoxypiperazine-2,5-dione