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CHEBI:220756 - Deepstreptin

ChEBI IDCHEBI:220756
ChEBI NameDeepstreptin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC69H116N20O20
Net Charge0
Average Mass1545.807
Monoisotopic Mass1544.86748
SMILESCCC(C)C(NC(=O)C(CC(C)C)NC(=O)C(CCC(N)=O)NC(=O)C(Cc1cncn1)NC(=O)CNC(=O)CNC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C1CC(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NCC(=O)NCC(=O)NC(C(C)O)C(=O)NC(C)C(=O)NC(CCCCN)C(=O)N1)C(=O)O
InChIInChI=1S/C69H116N20O20/c1-14-37(10)56(69(108)109)89-67(106)47(24-36(8)9)85-62(101)43(18-19-50(71)91)83-65(104)48(25-41-27-72-32-77-41)81-54(95)30-73-53(94)29-76-60(99)44(21-33(2)3)84-64(103)46(23-35(6)7)86-66(105)49-26-51(92)80-45(22-34(4)5)63(102)78-38(11)58(97)75-28-52(93)74-31-55(96)88-57(40(13)90)68(107)79-39(12)59(98)82-42(61(100)87-49)17-15-16-20-70/h27,32-40,42-49,56-57,90H,14-26,28-31,70H2,1-13H3,(H2,71,91)(H,72,77)(H,73,94)(H,74,93)(H,75,97)(H,76,99)(H,78,102)(H,79,107)(H,80,92)(H,81,95)(H,82,98)(H,83,104)(H,84,103)(H,85,101)(H,86,105)(H,87,100)(H,88,96)(H,89,106)(H,108,109)
InChIKeyKNUPGJIEXCRTQO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (31871149)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Deepstreptin (CHEBI:220756) is a peptide (CHEBI:16670)