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CHEBI:225597 - VM55597

ChEBI IDCHEBI:225597
ChEBI NameVM55597
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H33N3O6
Net Charge0
Average Mass507.587
Monoisotopic Mass507.23694
SMILESCN1C(=O)[C@]23C[C@H]4C(C)(C)[C@@]5(C[C@@]41CN2C(=O)C[C@@]3(C)O)C(=O)Nc1c5ccc2c1OC=CC(C)(C)O2
InChIInChI=1S/C28H33N3O6/c1-23(2)9-10-36-20-16(37-23)8-7-15-19(20)29-21(33)27(15)13-26-14-31-18(32)12-25(5,35)28(31,22(34)30(26)6)11-17(26)24(27,3)4/h7-10,17,35H,11-14H2,1-6H3,(H,29,33)/t17-,25+,26+,27+,28-/m0/s1
InChIKeyHHMKOJPJOSZYET-MGUBYGHDSA-N
Species of MetaboliteComponentSourceComments
Nocardiopsis gilva YIM 90087 (ncbitaxon:1235441) - PubMed (8226314)
ChEBI Ontology
Outgoing Relation(s)
VM55597 (CHEBI:225597) is a azaspiro compound (CHEBI:35624)
IUPAC Name 
(1'S,6'R,7'R,8R,9'S)-6'-hydroxy-4,4,6',10',10',13'-hexamethylspiro[10H-[1,4]dioxepino[2,3-g]indole-8,11'-3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane]-4',9,14'-trione
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31110637ChemSpider