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6alpha-methylprednisolone

PropertiesImage
MNX_IDMNXM38882 Image of MNXM38882
referencechebi:6888
formulaC22H30O5
global charge0
mol weight374.477
InChIKeyVHRSUDSXCMQTMA-PJHHCJLFSA-N
InChIInChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1
SMILESC[C@H]1C[C@@H]2[C@H]([C@@H](O)C[C@@]3(C)[C@H]2CC[C@]3(O)C(=O)CO)[C@@]2(C)C=CC(=O)C=C12
MNX internals
InChI (mnx)InChI=1/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1 Image of MNXM38882
SMILES (mnx)[CH3:1][C@H:12]1[CH2:8][C@H:14]2[C@@H:15]3[CH2:5][CH2:7][C@@:22]([C:18]([CH2:11][OH:23])=[O:26])([OH:27])[C@@:21]3([CH3:3])[CH2:10][C@H:17]([OH:25])[C@@H:19]2[C@@:20]2([CH3:2])[CH:6]=[CH:4][C:13](=[O:24])[CH:9]=[C:16]12
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:6888
chebi:6888
VHRSUDSXCMQTMA-PJHHCJLFSA-N 		6alpha-methylprednisolone
(6alpha,11beta)-11,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
1-dehydro-6alpha-methylhydrocortisone
11beta,17,21-trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione
6alpha-methyl-11beta,17alpha,21-triol-1,4-pregnadiene-3,20-dione
Delta(1)-6alpha-methylhydrocortisone
Medrate
Medrol
Medrone
Methylprednisolon
Solomet
Urbason
methylprednisolone
methylprednisolonum
metilprednisolona

CHEBI:50366
chebi:50366
VHRSUDSXCMQTMA-UWKORSIYSA-N 		6-methylprednisolone
(11beta)-11,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
11beta,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione

lipidmaps:LMST02030158
lipidmapsM:LMST02030158
VHRSUDSXCMQTMA-UWKORSIYSA-N 		6-methylprednisolone
(11beta)-11,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
11beta,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
O5
ST 22:4

lipidmaps:LMST02030178
lipidmapsM:LMST02030178
VHRSUDSXCMQTMA-PJHHCJLFSA-N 		6alpha-methylprednisolone
(6alpha,11beta)-11,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
1-dehydro-6alpha-methylhydrocortisone
11beta,17,21-trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione
6alpha-methyl-11beta,17alpha,21-triol-1,4-pregnadiene-3,20-dione
Delta(1)-6alpha-methylhydrocortisone
Methylprednisolone
O5
ST 22:4
hmdb:HMDB0247029
VHRSUDSXCMQTMA-UHFFFAOYSA-N 		A-Methapred
14,17-dihydroxy-14-(2-hydroxyacetyl)-2,8,15-trimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-dien-5-one
methylprednisolone

kegg.drug:D00407
keggD:D00407
VHRSUDSXCMQTMA-PJHHCJLFSA-N 		Methylprednisolone (JP18/USP/INN)
Medrol (TN)
hmdb:HMDB0015094
VHRSUDSXCMQTMA-PJHHCJLFSA-N 		Methylprednisolone
(1S,2R,8S,10S,11S,14R,15S,17S)-14,17-dihydroxy-14-(2-hydroxyacetyl)-2,8,15-trimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-dien-5-one
(6a,11b)-11,17,21-Trihydroxy-6-methylpregna-1,4-diene-3,20-dione
(6alpha,11beta)-11,17,21-Trihydroxy-6-methylpregna-1,4-diene-3,20-dione
(6alpha,11beta)-11,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
1-Dehydro-6a-methylhydrocortisone
1-Dehydro-6alpha-methylhydrocortisone
6 Methylprednisolone
6-Methylprednisolone
6a-Methyl-11b,17a,21-triol-1,4-pregnadiene-3,20-dione
6a-Methylprednisolone
6alpha-Methyl-11beta,17alpha,21-triol-1,4-pregnadiene-3,20-dione
6alpha-Methylprednisolone
6alpha-methyl-11beta,17alpha,21-triol-1,4-pregnadiene-3,20-dione
6alpha-methylprednisolone
Delta(1)-6alpha-Methylhydrocortisone
Medrate
Medric acid
Medrol
Medrone
Methyleneprednisolone
Methylprednisolon
Methylprednisolonum
Metilprednisolona
Metilprednisolone
Metipred
Solomet
Urbason
delta(1)-6a-Methylhydrocortisone
delta(1)-6a-methylhydrocortisone
delta(1)-6alpha-methylhydrocortisone
methylprednisolone

hmdb:HMDB15094
keggD:M_D00407 		secondary/obsolete/fantasy identifier