Neolymphostin C (CHEBI:202536)

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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	Neolymphostin C

ChEBI ID	CHEBI:202536

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C19H20N4O3

Net Charge

Average Mass

352.394

Monoisotopic Mass

352.15354

InChI

InChI=1S/C19H20N4O3/c1-4-10(2)19(25)23-14-8-12(20)17-16-11(9-21-17)7-13(22-18(14)16)15(24)5-6-26-3/h5-10,20,22H,4H2,1-3H3,(H,23,25)/t10-/m0/s1

InChIKey

MFQNBJQOCSKDST-JTQLQIEISA-N

SMILES

O=C(C=1NC=2C(NC(=O)[C@H](CC)C)=CC(=N)C=3C2C(C1)=CN3)C=COC

Metabolite of Species	Details
Salinispora arenicola CNS-205 (NCBI:txid391037)	See: PubMed

ChEBI Ontology
Outgoing	Neolymphostin C (CHEBI:202536) is a pyrroloquinoline (CHEBI:50918)

IUPAC Name

N-[11-imino-6-(3-methoxyprop-2-enoyl)-2,7-diazatricyclo[6.3.1.04,12]dodeca-1,3,5,8(12),9-pentaen-9-yl]-2-methylbutanamide