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CHEBI:220259 - Indocarbazostatin

ChEBI IDCHEBI:220259
ChEBI NameIndocarbazostatin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H21N3O7
Net Charge0
Average Mass511.490
Monoisotopic Mass511.13795
SMILESCCOC(=O)[C@]1(O)C[C@H]2O[C@]1(C)n1c3ccc(O)cc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4=O
InChIInChI=1S/C28H21N3O7/c1-3-37-26(35)28(36)11-17-30-15-7-5-4-6-13(15)18-20-21(25(34)29-24(20)33)19-14-10-12(32)8-9-16(14)31(23(19)22(18)30)27(28,2)38-17/h4-10,17,32,36H,3,11H2,1-2H3,(H,29,33,34)/t17-,27+,28-/m1/s1
InChIKeyLJOOYJUOJXUSEB-IIRCXYRXSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (12061542)
ChEBI Ontology
Outgoing Relation(s)
Indocarbazostatin (CHEBI:220259) is a indolocarbazole (CHEBI:51915)
IUPAC Name 
ethyl (15S,16S,18R)-10,16-dihydroxy-15-methyl-3,5-dioxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8(13),9,11,20,22,24,26-nonaene-16-carboxylate
Manual XrefsDatabases
8111794ChemSpider