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CHEBI:204189 - Okaramine N

ChEBI IDCHEBI:204189
ChEBI NameOkaramine N
Stars
Last Modified4 November 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H34N4O3
Net Charge0
Average Mass522.649
Monoisotopic Mass522.26309
SMILESC=CC(C)(C)N1c2ccccc2[C@@]2(O)C[C@H]3C(=O)N4/C=C\C(C)(C)c5nc6ccccc6c5C[C@H]4C(=O)N3[C@@H]12
InChIInChI=1S/C32H34N4O3/c1-6-31(4,5)36-23-14-10-8-12-21(23)32(39)18-25-27(37)34-16-15-30(2,3)26-20(19-11-7-9-13-22(19)33-26)17-24(34)28(38)35(25)29(32)36/h6-16,24-25,29,33,39H,1,17-18H2,2-5H3/b16-15-/t24-,25-,29-,32-/m0/s1
InChIKeyDRFHLOQDCWUMLI-HTLHSIKDSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (10705454)
ChEBI Ontology
Outgoing Relation(s)
Okaramine N (CHEBI:204189) is a pyrroloindole (CHEBI:48133)
Incoming Relation(s)
okaramine A (CHEBI:232464) has functional parent Okaramine N (CHEBI:204189)
IUPAC Name 
(1S,4R,12S,14S,17Z)-12-hydroxy-19,19-dimethyl-5-(2-methylbut-3-en-2-yl)-3,5,16,21-tetrazaheptacyclo[14.13.0.03,14.04,12.06,11.020,28.022,27]nonacosa-6,8,10,17,20(28),22,24,26-octaene-2,15-dione
UniProt Name  Source
okaramine NUniProt
Manual XrefsDatabases
9960433ChemSpider