CHEBI:203553 - Cortistatin H

ChEBI IDCHEBI:203553
ChEBI NameCortistatin H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H44N2O
Net Charge0
Average Mass460.706
Monoisotopic Mass460.34536
SMILESCc1cnccc1CCC(C)[C@H]1CC[C@@H]2[C@]1(C)CCC1=CC3=CC[C@@H](N(C)C)C[C@]34CC[C@@]12O4
InChIInChI=1S/C31H44N2O/c1-21(6-7-23-13-17-32-20-22(23)2)27-10-11-28-29(27,3)14-12-25-18-24-8-9-26(33(4)5)19-30(24)15-16-31(25,28)34-30/h8,13,17-18,20-21,26-28H,6-7,9-12,14-16,19H2,1-5H3/t21?,26-,27-,28-,29-,30-,31-/m1/s1
InChIKeyXWJPSPMNDHNLFX-RHIQJKQESA-N
Species of MetaboliteComponentSourceComments
Corticium (ncbitaxon:39180) - DOI (10.1016/j.tet.2007.02.112)
ChEBI Ontology
Outgoing Relation(s)
Cortistatin H (CHEBI:203553) is a methylpyridines (CHEBI:25340)
IUPAC Name 
(1S,2R,5R,6R,14R,16R)-N,N,6-trimethyl-5-[4-(3-methylpyridin-4-yl)butan-2-yl]-19-oxapentacyclo[14.2.1.01,9.02,6.011,16]nonadeca-9,11-dien-14-amine
Manual XrefsDatabases
23076259ChemSpider