CHEBI:206129 - Versiquinazoline 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 Versiquinazoline G
ChEBI ID CHEBI:206129
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information eMolecules:534594
Download Molfile XML SDF
Formula C26H24N4O6
Net Charge 0
Average Mass 488.500
Monoisotopic Mass 488.16958
InChI InChI=1S/C26H24N4O6/c1-35-21-19-27-16-9-5-3-7-14(16)20(31)28(19)18(22(32)36-2)13-26(34)15-8-4-6-10-17(15)29-23(26)30(21)25(11-12-25)24(29)33/h3-10,18,21,23,34H,11-13H2,1-2H3/t18-,21-,23-,26-/m0/s1
InChIKey HQUMCUDYLVSNGA-KAVAZWMKSA-N
SMILES O=C1N2C(=NC3=C1C=CC=C3)[C@H](OC)N4C5(C(=O)N6[C@@H]4[C@@](C[C@H]2C(=O)OC)(O)C7=C6C=CC=C7)CC5
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: PubMed
ChEBI Ontology
Outgoing Versiquinazoline G (CHEBI:206129) is a α-amino acid ester (CHEBI:46874)
IUPAC Name
methyl (2S,13S,15S,25R)-15-hydroxy-2-methoxy-11,23-dioxospiro[1,4,12,22-tetrazahexacyclo[13.9.1.03,12.05,10.016,21.022,25]pentacosa-3,5,7,9,16,18,20-heptaene-24,1'-cyclopropane]-13-carboxylate
Manual Xref Database
60596786 ChemSpider
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