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CHEBI:217015 - Versicoloritide A

ChEBI IDCHEBI:217015
ChEBI NameVersicoloritide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H37N5O5
Net Charge0
Average Mass559.667
Monoisotopic Mass559.27947
SMILESC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
InChIInChI=1S/C31H37N5O5/c1-20-27(37)33-23(18-21-10-4-2-5-11-21)30(40)36-17-9-15-26(36)29(39)34-24(19-22-12-6-3-7-13-22)31(41)35-16-8-14-25(35)28(38)32-20/h2-7,10-13,20,23-26H,8-9,14-19H2,1H3,(H,32,38)(H,33,37)(H,34,39)/t20-,23-,24-,25-,26-/m0/s1
InChIKeyWEORCYBDFCLEEX-REVLRCOSSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.tet.2011.07.003)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Versicoloritide A (CHEBI:217015) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(3S,6S,12S,15S,18S)-3,12-dibenzyl-15-methyl-1,4,10,13,16-pentazatricyclo[16.3.0.06,10]henicosane-2,5,11,14,17-pentone
Manual XrefsDatabases
28289006ChemSpider