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CHEBI:221479 - Pentaminomycin D

ChEBI IDCHEBI:221479
ChEBI NamePentaminomycin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H49N9O6
Net Charge0
Average Mass703.845
Monoisotopic Mass703.38058
SMILESCC(C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCCN(O)C(=N)N)NC(=O)[C@H](Cc2cnc3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O
InChIInChI=1S/C36H49N9O6/c1-20(2)29-34(49)42-28(18-23-19-39-25-14-9-8-13-24(23)25)32(47)40-26(15-10-16-45(51)36(37)38)31(46)41-27(17-22-11-6-5-7-12-22)33(48)43-30(21(3)4)35(50)44-29/h5-9,11-14,19-21,26-30,39,51H,10,15-18H2,1-4H3,(H3,37,38)(H,40,47)(H,41,46)(H,42,49)(H,43,48)(H,44,50)/t26-,27+,28-,29+,30-/m0/s1
InChIKeyKCWUMMUIGCKNGQ-PCPRHZMTSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32927831)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Pentaminomycin D (CHEBI:221479) is a oligopeptide (CHEBI:25676)