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CHEBI:216781 - Yangpumicin A

ChEBI IDCHEBI:216781
ChEBI NameYangpumicin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H17NO7
Net Charge0
Average Mass455.422
Monoisotopic Mass455.10050
SMILESC[C@@H](O)[C@@]12O[C@]13c1cc(O)c4c(c1N[C@H]2C#CC=CC#C[C@H]3O)C(=O)c1c(O)cccc1C4=O
InChIInChI=1S/C26H17NO7/c1-12(28)25-17-9-4-2-3-5-10-18(31)26(25,34-25)14-11-16(30)20-21(22(14)27-17)24(33)19-13(23(20)32)7-6-8-15(19)29/h2-3,6-8,11-12,17-18,27-31H,1H3/t12-,17+,18-,25+,26+/m1/s1
InChIKeyOBUHDEKWYQCPLP-DWOUCKERSA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - PubMed (29086572)
ChEBI Ontology
Outgoing Relation(s)
Yangpumicin A (CHEBI:216781) is a 6-hydroxy steroid (CHEBI:36849)
IUPAC Name 
(1S,17S,24R,26R)-4,11,24-trihydroxy-26-[(1R)-1-hydroxyethyl]-25-oxa-16-azahexacyclo[15.7.2.01,26.02,15.05,14.07,12]hexacosa-2,4,7(12),8,10,14,20-heptaen-18,22-diyne-6,13-dione