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CHEBI:222453 - 1′-(N-acetycysteinyl)-1′-deoxystreptophenazine A

ChEBI IDCHEBI:222453
ChEBI Name1′-(N-acetycysteinyl)-1′-deoxystreptophenazine A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H37N3O7S
Net Charge0
Average Mass583.707
Monoisotopic Mass583.23522
SMILESCOC(=O)c1cccc2nc3c([C@@H](SC[C@H](NC(C)=O)C(=O)O)[C@@H](CCCCC(C)C)C(=O)OC)cccc3nc12
InChIInChI=1S/C30H37N3O7S/c1-17(2)10-6-7-11-21(30(38)40-5)27(41-16-24(28(35)36)31-18(3)34)19-12-8-14-22-25(19)32-23-15-9-13-20(26(23)33-22)29(37)39-4/h8-9,12-15,17,21,24,27H,6-7,10-11,16H2,1-5H3,(H,31,34)(H,35,36)/t21-,24+,27-/m1/s1
InChIKeyQOVMGOYVZMBYEY-SSEPRJSISA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (35422124)
ChEBI Ontology
Outgoing Relation(s)
1′-(N-acetycysteinyl)-1′-deoxystreptophenazine A (CHEBI:222453) is a phenazines (CHEBI:39201)
IUPAC Name 
(2R)-2-acetamido-3-[(1S,2S)-2-methoxycarbonyl-1-(6-methoxycarbonylphenazin-1-yl)-7-methyloctyl]sulanylpropanoic acid