CHEBI:226888 - N-formyllapatin A

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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 N-formyllapatin A
ChEBI ID CHEBI:226888
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C24H19N5O4
Net Charge 0
Average Mass 441.447
Monoisotopic Mass 441.14370
InChI InChI=1S/C24H19N5O4/c1-12-21(32)29-16-9-5-3-7-14(16)24(23(29)27(12)11-30)10-17-20(31)26-18(24)19-25-15-8-4-2-6-13(15)22(33)28(17)19/h2-9,11-12,17-18,23H,10H2,1H3,(H,26,31)/t12-,17-,18+,23-,24-/m0/s1
InChIKey HPQKYBXWMZPYKB-ZEWIOJHOSA-N
SMILES O=C1N2C(=NC3=C1C=CC=C3)[C@H]4NC([C@@H]2C[C@]45C6=C(C=CC=C6)N7[C@@H]5N(C=O)[C@@H](C)C7=O)=O
Metabolite of Species Details
Penicillium adametzioides (NCBI:txid70094) See: DOI
ChEBI Ontology
Outgoing N-formyllapatin A (CHEBI:226888) is a pyridopyrimidine (CHEBI:38932)
IUPAC Name
(1S,2'S,3'aS,12S,16S)-2'-methyl-1',3,14-trioxospiro[2,10,13-triazatetracyclo[10.2.2.02,11.04,9]hexadeca-4,6,8,10-tetraene-16,4'-2,3a-dihydroimidazo[1,2-a]indole]-3'-carbaldehyde
Manual Xref Database
34981278 ChemSpider
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