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ChEBI
> Main
CHEBI:32043 - Prednisolone farnesylate
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ChEBI Ontology
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ChEBI Name
Prednisolone farnesylate
ChEBI ID
CHEBI:32043
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formulae
C36H50O6
C36H50O6
Net Charge
0
Average Mass
578.780
Monoisotopic Mass
578.36074
InChI
InChI=1S/C36H50O6/c1-
23(2)
9-
7-
10-
24(3)
11-
8-
12-
25(4)
19-
32(40)
42-
22-
31(39)
36(41)
18-
16-
29-
28-
14-
13-
26-
20-
27(37)
15-
17-
34(26,5)
33(28)
30(38)
21-
35(29,36)
6/h9,11,15,17,19-
20,28-
30,33,38,41H,7-
8,10,12-
14,16,18,21-
22H2,1-
6H3/b24-
11+,25-
19+/t28-
,29-
,30-
,33+,34-
,35-
,36-
/m0/s1
InChIKey
SBQAKZYUNWNIRL-WIPKXTQKSA-N
SMILES
C[C@@]
12[C@]
([C@]
3([C@]
([C@H]
(C1)
O)
([C@]
4(C)
C(CC3)
=CC(C=C4)
=O)
[H]
)
[H]
)
(CC[C@@]
2(C(COC(/C=C(/CC/C=C(/CCC=C(C)
C)
\C)
\C)
=O)
=O)
O)
[H]
ChEBI Ontology
Outgoing
Prednisolone farnesylate (
CHEBI:32043
)
is a
organic molecular entity (
CHEBI:50860
)
Synonyms
Sources
Farnerate (TN)
KEGG COMPOUND
PNF 21
KEGG COMPOUND
Prednisolone 21-all-trans-farnesylate
KEGG COMPOUND
Prednisolone farnesylate
KEGG COMPOUND
Manual Xrefs
Databases
2248
DrugCentral
D01998
KEGG DRUG
View more database links
Registry Number
Type
Source
118244-44-3
CAS Registry Number
KEGG COMPOUND
Last Modified
22 February 2017