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CHEBI:227187 - Xiamycin D

ChEBI IDCHEBI:227187
ChEBI NameXiamycin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H27NO4
Net Charge0
Average Mass393.483
Monoisotopic Mass393.19401
SMILESCOC(=O)[C@]1(C)[C@@H](O)CC[C@]2(C)c3cc4c(cc3[C@@H](O)C[C@@H]12)nc1ccccc14
InChIInChI=1S/C24H27NO4/c1-23-9-8-21(27)24(2,22(28)29-3)20(23)12-19(26)15-11-18-14(10-16(15)23)13-6-4-5-7-17(13)25-18/h4-7,10-11,19-21,25-27H,8-9,12H2,1-3H3/t19-,20+,21-,23+,24-/m0/s1
InChIKeyWOBXCEFZSIDGSC-SKWRHMBASA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (26698879)
ChEBI Ontology
Outgoing Relation(s)
Xiamycin D (CHEBI:227187) is a 6-hydroxy steroid (CHEBI:36849)
IUPAC Name 
methyl (14S,16R,17S,18S,21S)-14,18-dihydroxy-17,21-dimethyl-10-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),2,4,6,8,11-hexaene-17-carboxylate
Manual XrefsDatabases
58196472ChemSpider