Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:50366 - 6-methylprednisolone
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
6-methylprednisolone
ChEBI ID
CHEBI:50366
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
more structures >>
Molfile
Formula
C22H30O5
Net Charge
0
Average Mass
374.47060
Monoisotopic Mass
374.20932
InChI
InChI=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
InChIKey
VHRSUDSXCMQTMA-UWKORSIYSA-N
SMILES
CC1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12
ChEBI Ontology
Outgoing
6-methylprednisolone (
CHEBI:50366
)
has functional parent
prednisolone (
CHEBI:8378
)
6-methylprednisolone (
CHEBI:50366
)
is a
11β-hydroxy steroid (
CHEBI:35346
)
6-methylprednisolone (
CHEBI:50366
)
is a
17α-hydroxy steroid (
CHEBI:35342
)
6-methylprednisolone (
CHEBI:50366
)
is a
20-oxo steroid (
CHEBI:36885
)
6-methylprednisolone (
CHEBI:50366
)
is a
21-hydroxy steroid (
CHEBI:35344
)
6-methylprednisolone (
CHEBI:50366
)
is a
3-oxo-Δ
1
,Δ
4
-steroid (
CHEBI:77166
)
6-methylprednisolone (
CHEBI:50366
)
is a
primary α-hydroxy ketone (
CHEBI:139590
)
6-methylprednisolone (
CHEBI:50366
)
is a
tertiary α-hydroxy ketone (
CHEBI:139592
)
Incoming
6α-methylprednisolone (
CHEBI:6888
)
is a
6-methylprednisolone (
CHEBI:50366
)
IUPAC Name
11β,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
Synonym
Source
(11β)-11,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
ChEBI
Registry Number
Type
Source
7113955
Beilstein Registry Number
Beilstein
Last Modified
06 February 2018