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CHEBI:212098 - Sartoryglabramide B

Default Structure
ChEBI IDCHEBI:212098
ChEBI NameSartoryglabramide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H31N5O4
Net Charge0
Average Mass549.631
Monoisotopic Mass549.23760
SMILESO=C1Nc2ccccc2C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H]1Cc1cnc2ccccc12
InChIInChI=1S/C32H31N5O4/c38-29-26(17-20-9-2-1-3-10-20)36-31(40)28-15-8-16-37(28)32(41)23-12-5-7-14-25(23)34-30(39)27(35-29)18-21-19-33-24-13-6-4-11-22(21)24/h1-7,9-14,19,26-28,33H,8,15-18H2,(H,34,39)(H,35,38)(H,36,40)/t26-,27-,28-/m0/s1
InChIKeyQBZDCNZHEJSWAI-KCHLEUMXSA-N
Species of MetaboliteComponentSourceComments
Neosartorya (ncbitaxon:36629) - PubMed (27447650)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Sartoryglabramide B (CHEBI:212098) is a cyclic peptide (CHEBI:23449)
IUPAC Name 
(7S,10S,13S)-10-benzyl-13-(1H-indol-3-ylmethyl)-3,9,12,15-tetrazatricyclo[14.4.0.03,7]icosa-1(20),16,18-triene-2,8,11,14-tetrone
Manual XrefsDatabases
58197065ChemSpider