CHEBI:219227 - Okaramine T

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Okaramine T
ChEBI ID CHEBI:219227
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C28H30N4O3
Net Charge 0
Average Mass 470.573
Monoisotopic Mass 470.23179
InChI InChI=1S/C28H30N4O3/c1-16(2)11-12-17-7-6-8-19-18(14-29-23(17)19)13-22-24(33)32-25-28(35,15-27(32,3)26(34)31-22)20-9-4-5-10-21(20)30-25/h4-11,14,22,25,29-30,35H,12-13,15H2,1-3H3,(H,31,34)/t22-,25+,27-,28-/m0/s1
InChIKey MAWXLVYQWGQMKX-MZRLSVQCSA-N
SMILES O=C1N[C@H](C(=O)N2[C@]1(C[C@]3(O)C=4C=CC=CC4N[C@H]23)C)CC=5C6=C(C(=CC=C6)CC=C(C)C)NC5
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: DOI
ChEBI Ontology
Outgoing Okaramine T (CHEBI:219227) is a pyrroloindole (CHEBI:48133)
IUPAC Name
(1R,4S,7S,9S)-9-hydroxy-7-methyl-4-[[7-(3-methylbut-2-enyl)-1H-indol-3-yl]methyl]-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
Manual Xref Database
78438694 ChemSpider
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