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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:28818 - (24
R
)-24,25-dihydroxycalciol
Main
ChEBI Ontology
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ChEBI Name
(24
R
)-24,25-dihydroxycalciol
ChEBI ID
CHEBI:28818
ChEBI ASCII Name
(24R)-24,25-dihydroxycalciol
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:47128, CHEBI:9072, CHEBI:19806
Supplier Information
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Formula
C27H44O3
Net Charge
0
Average Mass
416.63646
Monoisotopic Mass
416.32905
InChI
InChI=1S/C27H44O3/c1-
18-
8-
12-
22(28)
17-
21(18)
11-
10-
20-
7-
6-
16-
27(5)
23(13-
14-
24(20)
27)
19(2)
9-
15-
25(29)
26(3,4)
30/h10-
11,19,22-
25,28-
30H,1,6-
9,12-
17H2,2-
5H3/b20-
10+,21-
11-
/t19-
,22+,23-
,24+,25-
,27-
/m1/s1
InChIKey
FCKJYANJHNLEEP-XRWYNYHCSA-N
SMILES
[H][C@@]1(CC[C@]2([H])[C@]1(C)CCC\C2=C/C=C1/C[C@@H](O)CCC1=C)[C@H](C)CC[C@@H](O)C(C)(C)O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
DOI
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(24
R
)-24,25-dihydroxycalciol (
CHEBI:28818
)
has role
human metabolite (
CHEBI:77746
)
(24
R
)-24,25-dihydroxycalciol (
CHEBI:28818
)
is a
hydroxy seco-steroid (
CHEBI:36853
)
(24
R
)-24,25-dihydroxycalciol (
CHEBI:28818
)
is a
hydroxycalciol (
CHEBI:47042
)
(24
R
)-24,25-dihydroxycalciol (
CHEBI:28818
)
is a
seco-cholestane (
CHEBI:36818
)
IUPAC Name
(3
S
,5
Z
,7
E
,24
R
)-9,10-secocholesta-5,7,10-triene-3,24,25-triol
Synonyms
Sources
(24R)-24,25-dihydroxycholecalciferol
LIPID MAPS
(24R)-24,25-dihydroxyvitamin D
3
LIPID MAPS
24(R),25-Dihydroxyvitamin D3
KEGG COMPOUND
24
R
,25(OH)
2
D
3
ChEBI
24
R
,25-dihydroxycholecalciferol
ChEBI
24
R
,25-dihydroxyvitamin D
3
ChEBI
Secalciferol
KEGG COMPOUND
secalciferol
UniProt
Manual Xrefs
Databases
2426
DrugCentral
C07712
KEGG COMPOUND
D00628
KEGG DRUG
LMST03020273
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
4567039
Beilstein Registry Number
Beilstein
55721-11-4
CAS Registry Number
KEGG COMPOUND
Last Modified
22 February 2017