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

LSM-38985

PropertiesImageOccurences in reactions
MNX_IDMNXM530060Image of MNXM530060
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC25H35N3O6
charge0
mass473.25259
referencechebi:127427
InChIKeyKBGVHZBKJITMSF-BCLDRZJSSA-N
InChIInChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-11-10-18-7-9-21(31-4)23(34-18)15-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23+/m1/s1
SMILESCO[C@@H]1CN(C)C(=O)c2cc(C#N)ccc2OCC[C@@H]2CC[C@@H](OC)[C@H](CN(C)C(=O)[C@@H]1C)O2
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:127427
chebi:127427 		LSM-38985