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mycophenolate mofetil

MNXM19487 is deprecated and here replaced by MNXM732157
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM732157 Image of MNXM732157
referencechebi:8764
formulaC23H31NO7
global charge0
mol weight433.501
InChIKeyRTGDFNSFWBGLEC-SYZQJQIISA-N
InChIInChI=1S/C23H31NO7/c1-15(5-7-19(25)30-13-10-24-8-11-29-12-9-24)4-6-17-21(26)20-18(14-31-23(20)27)16(2)22(17)28-3/h4,26H,5-14H2,1-3H3/b15-4+
SMILESCOC1=C(C/C=C(\C)CCC(=O)OCCN2CCOCC2)C(O)=C2C(=O)OCC2=C1C
MNX internals
InChI (mnx)InChI=1/C23H31NO7/c1-15(5-7-19(25)30-13-10-24-8-11-29-12-9-24)4-6-17-21(26)20-18(14-31-23(20)27)16(2)22(17)28-3/h4,26H,5-14H2,1-3H3/b15-4+ Image of MNXM732157
SMILES (mnx)[CH3:1]/[C:15](=[CH:4]\[CH2:6][C:17]1=[C:22]([O:28][CH3:3])[C:16]([CH3:2])=[C:18]2[CH2:14][O:31][C:23](=[O:27])[C:20]2=[C:21]1[OH:26])[CH2:5][CH2:7][C:19](=[O:25])[O:30][CH2:13][CH2:10][N:24]1[CH2:8][CH2:11][O:29][CH2:12][CH2:9]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:8764
chebi:8764
RTGDFNSFWBGLEC-SYZQJQIISA-N 		mycophenolate mofetil
2-(morpholin-4-yl)ethyl (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoate
2-morpholinoethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoate
Cellcept
MMF
RS 61443
mycophenolic acid morpholinoethyl ester

kegg.drug:D00752
keggD:D00752
RTGDFNSFWBGLEC-SYZQJQIISA-N 		Mycophenolate mofetil (JAN/USP)
Cellcept (TN)
hmdb:HMDB0014826
RTGDFNSFWBGLEC-SYZQJQIISA-N 		Mycophenolate mofetil
2-(morpholin-4-yl)ethyl (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoate
2-Morpholinoethyl (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoate
2-Morpholinoethyl (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid
Cellcept
MMF
Mofetil hydrochloride, mycophenolate
Mofetil, mycophenolate
Mycophenolate mofetil hydrochloride
Mycophenolate morpholinoethyl ester
Mycophenolate sodium
Mycophenolate, sodium
Mycophenolic acid
Mycophenolic acid mofetil
Mycophenolic acid morpholinoethyl ester
Mycophenylate mofetil
Myfortic
RS 61443
Sodium mycophenolate
mycophenolate mofetil

kegg.compound:C07908
keggC:C07908
RTGDFNSFWBGLEC-SYZQJQIISA-N 		Mycophenolate mofetil
RS 61443

seed.compound:cpd04959
seedM:cpd04959
RTGDFNSFWBGLEC-SYZQJQIISA-N 		RS 61443
MMF
Mycophenolate mofetil
Mycophenolate_mofetil
mycophenolate mofetil

metacyc.compound:CPD-14603
metacycM:CPD-14603
RTGDFNSFWBGLEC-SYZQJQIISA-N 		mycophenolate mofetil
MMF

hmdb:HMDB14826
keggC:M_C07908
keggD:M_D00752
seedM:M_cpd04959 		secondary/obsolete/fantasy identifier