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CHEBI:209166 - 3'-O-demethyl-4'-N-demethyl-4'-N-acetyl-4'-epi-staurosporine

ChEBI IDCHEBI:209166
ChEBI Name3'-O-demethyl-4'-N-demethyl-4'-N-acetyl-4'-epi-staurosporine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H24N4O4
Net Charge0
Average Mass480.524
Monoisotopic Mass480.17976
SMILESCC(=O)N[C@@H]1C[C@H]2O[C@@](C)([C@@H]1O)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4
InChIInChI=1S/C28H24N4O4/c1-13(33)30-17-11-20-31-18-9-5-3-7-14(18)22-23-16(12-29-27(23)35)21-15-8-4-6-10-19(15)32(25(21)24(22)31)28(2,36-20)26(17)34/h3-10,17,20,26,34H,11-12H2,1-2H3,(H,29,35)(H,30,33)/t17-,20-,26-,28+/m1/s1
InChIKeyPTQKRNULLCXNRU-FYTWVXJKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (29558119)
ChEBI Ontology
Outgoing Relation(s)
3'-O-demethyl-4'-N-demethyl-4'-N-acetyl-4'-epi-staurosporine (CHEBI:209166) is a indolocarbazole (CHEBI:51915)
IUPAC Name 
N-[(2S,3R,4R,6R)-3-hydroxy-2-methyl-16-oxo-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-4-yl]acetamide
Manual XrefsDatabases
78441679ChemSpider