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CHEBI:207421 - Oridamycin B

ChEBI IDCHEBI:207421
ChEBI NameOridamycin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H25NO4
Net Charge0
Average Mass379.456
Monoisotopic Mass379.17836
SMILESC[C@]12CC[C@H](O)[C@](CO)(C(=O)O)[C@@H]1CCc1cc3nc4ccccc4c3cc12
InChIInChI=1S/C23H25NO4/c1-22-9-8-20(26)23(12-25,21(27)28)19(22)7-6-13-10-18-15(11-16(13)22)14-4-2-3-5-17(14)24-18/h2-5,10-11,19-20,24-26H,6-9,12H2,1H3,(H,27,28)/t19-,20+,22-,23-/m1/s1
InChIKeyOLMKVWKEEMDZBW-IRMYBRCSSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies KS84 (ncbitaxon:746563) - PubMed (20369841)
ChEBI Ontology
Outgoing Relation(s)
Oridamycin B (CHEBI:207421) is a steroid acid (CHEBI:47891)
IUPAC Name 
(16R,17S,18S,21S)-18-hydroxy-17-(hydroxymethyl)-21-methyl-10-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12-hexaene-17-carboxylic acid
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35000172ChemSpider