CHEBI:219376 - Polanrazine E

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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 Polanrazine E
ChEBI ID CHEBI:219376
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C17H21N3O4
Net Charge 0
Average Mass 331.372
Monoisotopic Mass 331.15321
InChI InChI=1S/C17H21N3O4/c1-10(2)17(24-3)15(22)19-16(23,14(21)20-17)8-11-9-18-13-7-5-4-6-12(11)13/h4-7,9-10,18,23H,8H2,1-3H3,(H,19,22)(H,20,21)/t16-,17-/m1/s1
InChIKey CZKPEZCMZQJQAP-IAGOWNOFSA-N
SMILES O=C1N[C@](O)(C(=O)N[C@@]1(OC)C(C)C)CC=2C3=C(C=CC=C3)NC2
Metabolite of Species Details
Plenodomus lingam (NCBI:txid5022) See: DOI
ChEBI Ontology
Outgoing Polanrazine E (CHEBI:219376) has functional parent α-amino acid (CHEBI:33704)
Polanrazine E (CHEBI:219376) is a organonitrogen compound (CHEBI:35352)
Polanrazine E (CHEBI:219376) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(3R,6R)-3-hydroxy-3-(1H-indol-3-ylmethyl)-6-methoxy-6-propan-2-ylpiperazine-2,5-dione
Manual Xref Database
9122745 ChemSpider
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