Feedback

Isoandrocymbine

PropertiesImageOccurences in reactions
MNX_IDMNXM91210Image of MNXM91210
#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
formulaC21H25NO5
charge0
mass371.17327
referencechebi:80673
InChIKeyIJGDMFUAWANQSX-LHSJRXKWSA-N
InChIInChI=1S/C21H25NO5/c1-22-8-7-21-11-17(25-2)15(23)10-13(21)14(22)6-5-12-9-16(24)19(26-3)20(27-4)18(12)21/h9-11,14,24H,5-8H2,1-4H3/t14-,21+/m0/s1
SMILESCOC1=C[C@@]23CCN(C)[C@@H](CCc4cc(O)c(OC)c(OC)c42)C3=CC1=O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd16515
seedM:cpd16515
CHEBI:80673
chebi:80673
kegg.compound:C16708
keggC:C16708
Isoandrocymbine
metacyc.compound:CPD-9789
metacycM:CPD-9789
seed.compound:cpd25839
seedM:cpd25839
(S)-isoandrocymbine
keggC:M_C16708
seedM:M_cpd16515
seedM:M_cpd25839
secondary/obsolete/fantasy identifier