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:166835 - tachysterol 3
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
tachysterol 3
ChEBI ID
CHEBI:166835
Definition
A hydroxy seco-steroid that results from the photoisomerization of previtamin D
3
.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C27H44O
Net Charge
0
Average Mass
384.648
Monoisotopic Mass
384.33922
InChI
InChI=1S/C27H44O/c1-
19(2)
8-
6-
9-
21(4)
25-
15-
16-
26-
22(10-
7-
17-
27(25,26)
5)
12-
13-
23-
18-
24(28)
14-
11-
20(23)
3/h10,12-
13,19,21,24-
26,28H,6-
9,11,14-
18H2,1-
5H3/b13-
12+/t21-
,24+,25-
,26+,27-
/m1/s1
InChIKey
YUGCAAVRZWBXEQ-FMCTZRJNSA-N
SMILES
[H][C@@]1(CC[C@@]2([H])C(\C=C\C3=C(C)CC[C@H](O)C3)=CCC[C@]12C)[C@H](C)CCCC(C)C
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in skin
(BTO:0001253)
. See:
PubMed
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
tachysterol 3 (
CHEBI:166835
)
has role
human metabolite (
CHEBI:77746
)
tachysterol 3 (
CHEBI:166835
)
is a
hydroxy seco-steroid (
CHEBI:36853
)
tachysterol 3 (
CHEBI:166835
)
is a
seco-cholestane (
CHEBI:36818
)
tachysterol 3 (
CHEBI:166835
)
is a
secondary alcohol (
CHEBI:35681
)
IUPAC Name
(3
S
,6
E
)-9,10-secocholesta-5(10),6,8-trien-3-ol
Synonyms
Sources
(3β,6
E
)-9,10-secocholesta-5(10),6,8-trien-3-ol
ChemIDplus
(6
E
)-(3
S
)-9,10-seco-5(10),6,8-cholestatrien-3-ol
LIPID MAPS
(6
E
)-9,10-secocholesta-5(10),6,8-trien-3β-ol
ChEBI
(6
E
)-tacalciol
ChEBI
tacalciol
ChEBI
tachysterol 3
UniProt
tachysterol
3
ChEBI
tachysterol3
ChemIDplus
Manual Xrefs
Databases
4446802
ChemSpider
FDB023972
FooDB
HMDB0006560
HMDB
LMST03020223
LIPID MAPS
View more database links
Registry Number
Type
Source
17592-07-3
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10876100
PubMed citation
SUBMITTER
1332420
PubMed citation
Europe PMC
19028513
PubMed citation
Europe PMC
6256855
PubMed citation
Europe PMC
6265564
PubMed citation
Europe PMC
6275887
PubMed citation
Europe PMC
6281884
PubMed citation
Europe PMC
Last Modified
27 November 2020