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CHEBI:208682 - 17-hydroxy-8-desmethoxy-isomigrastatin

ChEBI IDCHEBI:208682
ChEBI Name17-hydroxy-8-desmethoxy-isomigrastatin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H37NO7
Net Charge0
Average Mass475.582
Monoisotopic Mass475.25700
SMILESC/C(=C\[C@H](C)C(=O)C[C@H](O)CC1CC(=O)NC(=O)C1)[C@@H]1OC(=O)/C=C/CC/C=C/C[C@@H](O)[C@@H]1C
InChIInChI=1S/C26H37NO7/c1-16(22(30)15-20(28)12-19-13-23(31)27-24(32)14-19)11-17(2)26-18(3)21(29)9-7-5-4-6-8-10-25(33)34-26/h5,7-8,10-11,16,18-21,26,28-29H,4,6,9,12-15H2,1-3H3,(H,27,31,32)/b7-5+,10-8+,17-11+/t16-,18-,20+,21+,26-/m0/s1
InChIKeyIVFXTQLBVDABOI-DVYWRAFASA-N
Species of MetaboliteComponentSourceComments
Streptomyces platensis (ncbitaxon:58346) - PubMed (16117518)
ChEBI Ontology
Outgoing Relation(s)
17-hydroxy-8-desmethoxy-isomigrastatin (CHEBI:208682) is a macrolide (CHEBI:25106)
IUPAC Name 
4-[(E,2R,5S)-2-hydroxy-7-[(2R,3S,4R,6E,10E)-4-hydroxy-3-methyl-12-oxo-1-oxacyclododeca-6,10-dien-2-yl]-5-methyl-4-oxooct-6-enyl]piperidine-2,6-dione
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78437926ChemSpider