CHEBI:223196 - Okaramine G

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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 G
ChEBI ID CHEBI:223196
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H34N4O3
Net Charge 0
Average Mass 522.649
Monoisotopic Mass 522.26309
InChI InChI=1S/C32H34N4O3/c1-7-30(3,4)26-20(19-13-9-11-15-22(19)33-26)17-23-28(38)35-25(27(37)34-23)18-32(39)21-14-10-12-16-24(21)36(29(32)35)31(5,6)8-2/h7-17,25,29,33,39H,1-2,18H2,3-6H3,(H,34,37)/b23-17-/t25-,29-,32-/m1/s1
InChIKey KHWPPFCYPOTQML-TUXURQOUSA-N
SMILES O=C/1N2[C@@H]3N(C=4C=CC=CC4[C@]3(O)C[C@@H]2C(=O)N\C1=C/C=5C6=C(C=CC=C6)NC5C(C=C)(C)C)C(C=C)(C)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing Okaramine G (CHEBI:223196) is a pyrroloindole (CHEBI:48133)
IUPAC Name
(1S,4Z,7R,9R)-9-hydroxy-16-(2-methylbut-3-en-2-yl)-4-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methylidene]-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
Manual Xref Database
78438260 ChemSpider
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