CHEBI:68032 - Eusynstyelamide D

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ChEBI Name Eusynstyelamide D
ChEBI ID CHEBI:68032
Definition A natural product found in Tegella cf. spitzbergensis.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H36Br2N6O4
Net Charge 0
Average Mass 704.45300
Monoisotopic Mass 702.11648
InChI InChI=1S/C30H36Br2N6O4/c31-19-5-7-21-18(16-36-24(21)13-19)15-29(41)26(23-17-37-25-14-20(32)6-8-22(23)25)30(42,27(39)35-11-3-1-9-33)38(28(29)40)12-4-2-10-34/h5-8,13-14,16-17,26,36-37,41-42H,1-4,9-12,15,33-34H2,(H,35,39)/t26-,29+,30+/m1/s1
InChIKey PIHIJDUVKHNVTR-POLDFPFKSA-N
SMILES NCCCCNC(=O)[C@@]1(O)[C@H](c2c[nH]c3cc(Br)ccc23)[C@@](O)(Cc2c[nH]c3cc(Br)ccc23)C(=O)N1CCCCN
Metabolite of Species Details
Tegella cf. sp.tzbergensis (NCBI:txid546940) Lyophilized material of the bryozoan was extracted with CH2Cl2/MeOH (1:1) See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Eusynstyelamide D (CHEBI:68032) has role metabolite (CHEBI:25212)
Eusynstyelamide D (CHEBI:68032) is a amino acid amide (CHEBI:22475)
Synonym Source
(2S,3R,4S)-N,1-bis(4-aminobutyl)-3-(6-bromo-1H-indol-3-yl)-4-[(6-bromo-1H-indol-3-yl)methyl]-2,4-dihydroxy-5-oxopyrrolidine-2-carboxamide ChEBI
Citation Waiting for Citations Type Source
21370896 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:indoles(CHEBI:24828); ISA:pyrrolidinecarboxamide(CHEBI:46770); ISA:organobromine compound(CHEBI:37141); ISA:aralkylamine(CHEBI:18000); ISA:pyrroles(CHEBI:26455); ISA:pyrrolidine-2-ones(CHEBI:74223); ISA:N-alkylpyrrolidine(CHEBI:46775); ISA:tertiary alcohol(CHEBI:26878); ISA:carboxamide(CHEBI:37622); ISA:tertiary amine(CHEBI:32876); ISA:lactam(CHEBI:24995); ISA:organonitrogen compound(CHEBI:35352); ISA:carboxylic acid(CHEBI:33575); ISA:amino alcohol(CHEBI:22478); ISA:carbonyl compound(CHEBI:36586); ISA:alkylamine(CHEBI:13759);