Marinacarboline G (CHEBI:224682)

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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	Marinacarboline G

ChEBI ID	CHEBI:224682

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C24H21N3O3

Net Charge

Average Mass

399.450

Monoisotopic Mass

399.15829

InChI

InChI=1S/C24H21N3O3/c1-24(30-3)26(14-13-16-9-5-4-6-10-16)22(28)20-15-18-17-11-7-8-12-19(17)25(2)21(18)23(29)27(20)24/h4-15H,1-3H3/b14-13-/t24-/m0/s1

InChIKey

KQGIOFULIYUITH-XWDDPXMASA-N

SMILES

O=C1N2C(C(=O)N([C@@]2(OC)C)/C=C\C3=CC=CC=C3)=CC4=C1N(C=5C=CC=CC45)C

Metabolite of Species	Details
Actinoalloteichus (NCBI:txid65496)	See: PubMed

ChEBI Ontology
Outgoing	Marinacarboline G (CHEBI:224682) is a β-carbolines (CHEBI:60834)

IUPAC Name

(12S)-12-methoxy-8,12-dimethyl-13-[(Z)-2-phenylethenyl]-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6,15-pentaene-10,14-dione