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CHEBI:214019 - Basidiosin B

ChEBI IDCHEBI:214019
ChEBI NameBasidiosin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H44N6O6
Net Charge0
Average Mass584.718
Monoisotopic Mass584.33223
SMILESCC(C)C[C@@H]1NC(=O)[C@H](Cc2cnc3ccccc23)NC(=O)[C@@H](CO)NC(=O)[C@@H](C(C)C)NC(=O)[C@H](C(C)C)NC1=O
InChIInChI=1S/C30H44N6O6/c1-15(2)11-21-27(39)35-25(17(5)6)30(42)36-24(16(3)4)29(41)34-23(14-37)28(40)33-22(26(38)32-21)12-18-13-31-20-10-8-7-9-19(18)20/h7-10,13,15-17,21-25,31,37H,11-12,14H2,1-6H3,(H,32,38)(H,33,40)(H,34,41)(H,35,39)(H,36,42)/t21-,22-,23+,24+,25-/m0/s1
InChIKeyNMGYNDIPSWARCQ-LJXDPWEESA-N
Species of MetaboliteComponentSourceComments
Basidiobolus meristosporus (ncbitaxon:423460) - PubMed (32565347)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Basidiosin B (CHEBI:214019) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(3R,6R,9S,12S,15S)-3-(hydroxymethyl)-15-(1H-indol-3-ylmethyl)-12-(2-methylpropyl)-6,9-di(propan-2-yl)-1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone