Search MNXref
 Feedback

rosuvastatin

MNXM160891 is deprecated and here replaced by MNXM1368486
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368486 Image of MNXM1368486
referencechebi:38545
formulaC22H28FN3O6S
global charge0
mol weight481.546
InChIKeyBPRHUIZQVSMCRT-VEUZHWNKSA-N
InChIInChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m1/s1
SMILESCC(C)C1=NC(N(C)S(C)(=O)=O)=NC(C2=CC=C(F)C=C2)=C1/C=C/[C@@H](O)C[C@@H](O)CC(=O)O
MNX internals
InChI (mnx)InChI=1/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m1/s1 Image of MNXM1368486
SMILES (mnx)[CH3:1][CH:13]([CH3:2])[C:20]1=[C:18](/[CH:10]=[CH:9]/[C@H:16]([CH2:11][C@H:17]([CH2:12][C:19](=[O:29])[OH:30])[OH:28])[OH:27])[C:21]([C:14]2=[CH:6][CH:8]=[C:15]([F:23])[CH:7]=[CH:5]2)=[N:25][C:22]([N:26]([CH3:3])[S:33]([CH3:4])(=[O:31])=[O:32])=[N:24]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:38545
chebi:38545
BPRHUIZQVSMCRT-VEUZHWNKSA-N 		rosuvastatin
(3R,5S,6E)-7-(4-(4-fluorophenyl)-6-(1-methylethyl)-2-(ethyl(methylsulfonyl)amino)-5-pyrimidinyl)-3,5-dihydroxy-6-heptenoic acid
(3R,5S,6E)-7-{4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-(propan-2-yl)pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoic acid
(3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoic acid

kegg.drug:D08492
keggD:D08492
BPRHUIZQVSMCRT-VEUZHWNKSA-N 		Rosuvastatin (INN)
Creston (TN)
hmdb:HMDB0015230
BPRHUIZQVSMCRT-VEUZHWNKSA-N 		Rosuvastatin
(3R,5S,6E)-7-(4-(4-Fluorophenyl)-6-(1-methylethyl)-2-(ethyl(methylsulfonyl)amino)-5-pyrimidinyl)-3,5-dihydroxy-6-heptenoate
(3R,5S,6E)-7-(4-(4-Fluorophenyl)-6-(1-methylethyl)-2-(ethyl(methylsulfonyl)amino)-5-pyrimidinyl)-3,5-dihydroxy-6-heptenoic acid
(3R,5S,6E)-7-(4-(4-Fluorophenyl)-6-(1-methylethyl)-2-(ethyl(methylsulphonyl)amino)-5-pyrimidinyl)-3,5-dihydroxy-6-heptenoate
(3R,5S,6E)-7-(4-(4-Fluorophenyl)-6-(1-methylethyl)-2-(ethyl(methylsulphonyl)amino)-5-pyrimidinyl)-3,5-dihydroxy-6-heptenoic acid
(3R,5S,6E)-7-[4-(4-fluorophenyl)-2-(N-methylmethanesulfonamido)-6-(propan-2-yl)pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid
(3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoate
(3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoic acid
(3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulphonyl)amino]pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoate
(3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulphonyl)amino]pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoic acid
Calcium, rosuvastatin
Creston
Crestor
Rosuvastatin calcium
ZD-4522
rosuvastatin

CHEBI:77313
chebi:77313
BPRHUIZQVSMCRT-VEUZHWNKSA-M 		rosuvastatin(1-)
(3R,5S,6E)-7-{4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-(propan-2-yl)pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoate
rosuvastatin anion

vmhM:rsv
vmhmetabolite:rsv
BPRHUIZQVSMCRT-VEUZHWNKSA-N 		rosuvastatin
(3R,5S,6E)-7-[4-(4-fluorophenyl)-2-(N-methylmethanesulfonamido)-6-(propan-2-yl)pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid

hmdb:HMDB15230
keggD:M_D08492
vmhM:M_rsv 		secondary/obsolete/fantasy identifier