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Roquefortine F

MNXM148504 is deprecated and replaced by MNXM1100400
PropertiesImageOccurences in reactions
MNX_IDMNXM1100400Image of MNXM1100400
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
formulaC23H25N5O3
charge0
mass419.19574
referencekeggC:C22171
InChIKeyUGXLTDJSORIITQ-MHWRWJLKSA-N
InChIInChI=1S/C23H25N5O3/c1-5-22(2,3)23-11-18-19(29)26-16(10-14-12-24-13-25-14)20(30)27(18)21(23)28(31-4)17-9-7-6-8-15(17)23/h5-10,12-13,18,21H,1,11H2,2-4H3,(H,24,25)(H,26,29)/b16-10+
SMILESC=CC(C)(C)C12CC3C(=O)N/C(=C/c4c[nH]cn4)C(=O)N3C1N(OC)c1ccccc12
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
kegg.compound:C22171
keggC:C22171
Roquefortine F
metacyc.compound:CPD-17393
metacycM:CPD-17393
seed.compound:cpd31551
seedM:cpd31551
roquefortine F
keggC:M_C22171
seedM:M_cpd31551
secondary/obsolete/fantasy identifier