CHEBI:215253 - 2R, 3R-dioxeto-Cyclo-(L-Trp-L-Phe)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 2R, 3R-dioxeto-Cyclo-(L-Trp-L-Phe)
ChEBI ID CHEBI:215253
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H19N3O4
Net Charge 0
Average Mass 365.389
Monoisotopic Mass 365.13756
InChI InChI=1S/C20H19N3O4/c24-17-15(10-12-6-2-1-3-7-12)21-18(25)16(22-17)11-20-13-8-4-5-9-14(13)23-19(20)26-27-20/h1-9,15-16,19,23H,10-11H2,(H,21,25)(H,22,24)/t15-,16-,19+,20?/m0/s1
InChIKey XUBXAEDFVKDGRD-CAHGDOEDSA-N
SMILES O=C1N[C@H](C(=O)N[C@H]1CC2=CC=CC=C2)CC34OO[C@H]3NC5=C4C=CC=C5
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: DOI
ChEBI Ontology
Outgoing 2R, 3R-dioxeto-Cyclo-(L-Trp-L-Phe) (CHEBI:215253) has functional parent α-amino acid (CHEBI:33704)
2R, 3R-dioxeto-Cyclo-(L-Trp-L-Phe) (CHEBI:215253) is a organonitrogen compound (CHEBI:35352)
2R, 3R-dioxeto-Cyclo-(L-Trp-L-Phe) (CHEBI:215253) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(3S,6S)-3-[[(2aR)-2a,3-dihydrodioxeto[3,4-b]indol-7b-yl]methyl]-6-benzylpiperazine-2,5-dione