Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

13-Oxocryptopine

PropertiesImageOccurences in reactions
MNX_IDMNXM116160Image of MNXM116160
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC21H21NO6
charge0
mass383.13689
referencehmdb:HMDB0032878
InChIKeyUFCVPEFVGGMGSE-UHFFFAOYSA-N
InChIInChI=1S/C21H21NO6/c1-22-7-6-12-8-17(25-2)18(26-3)9-14(12)20(24)19(23)13-4-5-16-21(15(13)10-22)28-11-27-16/h4-5,8-9H,6-7,10-11H2,1-3H3
SMILESCOc1cc2c(cc1OC)C(=O)C(=O)c1ccc3c(c1CN(C)CC2)OCO3
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0032878 13-Oxocryptopine
14-Oxocryptopine
6,7-dimethoxy-12-methyl-16,18-dioxa-12-azatetracyclo[12.7.0.0⁴,⁹.0¹⁵,¹⁹]henicosa-1(14),4(9),5,7,15(19),20-hexaene-2,3-dione
hmdb:HMDB32878 secondary/obsolete/fantasy identifier