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CHEBI:221783 - Sch 38519

ChEBI IDCHEBI:221783
ChEBI NameSch 38519
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H25NO8
Net Charge0
Average Mass455.463
Monoisotopic Mass455.15802
SMILESC[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1c(O)cc3c(c1C2=O)[C@H]1C[C@@H](N(C)C)[C@H](O)[C@]3(C)O1
InChIInChI=1S/C24H25NO8/c1-8-15-19(22-13(31-8)7-14(27)32-22)21(29)18-16-9(5-11(26)17(18)20(15)28)24(2)23(30)10(25(3)4)6-12(16)33-24/h5,8,10,12-13,22-23,26,30H,6-7H2,1-4H3/t8-,10-,12-,13-,22+,23+,24-/m1/s1
InChIKeyJZGRDBGLULKCDD-HFJLKIIDSA-N
Species of MetaboliteComponentSourceComments
Thermomonospora (ncbitaxon:2019) - PubMed (2753813)
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
Sch 38519 (CHEBI:221783) is a benzoisochromanequinone (CHEBI:48129)
IUPAC Name 
(1R,6R,10R,12R,19R,20S,21R)-21-(dimethylamino)-16,20-dihydroxy-12,19-dimethyl-7,11,23-trioxahexacyclo[17.3.1.02,18.03,15.05,13.06,10]tricosa-2,5(13),15,17-tetraene-4,8,14-trione
Manual XrefsDatabases
8181433ChemSpider