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Substance
ID:1821788
Structure
Similarity
Functional Group
Text
ID:4141
estriol
Chemical Entities of Biological Interest
ID: CHEBI:27974
Names and Identifiers
Brand Name
Estriel
IUPAC Traditional name
estriol
Synonyms
estriol
(16alpha,17beta)-estra-1,3,5(10)-triene-3,16,17-triol
1,3,5(10)-Estratriene-3,16-alpha,17beta-triol
16alpha,17beta-estriol
16alpha-hydroxyestradiol
3,16alpha,17beta-trihydroxy-Delta(1,3,5)-estratriene
ESTRIOL
Estriol
Oestriol
oestriol
trihydroxyestrin
IUPAC name
(1R,2R,3aS,3bR,9bS,11aS)-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,2,7-triol
Registration numbers
CAS Number
50-27-1
PubChem CID
5756
KEGG ID
C05141
DrugBank ID
DB04573
Wikipedia Title
Estriol
Beilstein Number
2508172
LINCS Database
LSM-2368
LIPID MAPS Instance
LMST02010003
MetaCyc Database
ESTRIOL
PubMed Citation Links
11133265
23777262
9373313
Reaxys Registry
2508172
ACToR Database
50-27-1
BKMS React Database
52134
175124
3202
BRENDA Database
1.1.1.21
1.4.1.3
5.1.3.3
1.14.14.154
2.4.1.17
2.8.2.4
2.8.2.2
1.11.1.7
1.14.15.36
3.1.6.8
1.1.1.147
1.14.14.14
3.2.1.31
2.8.2.15
BRENDA Ligand Database
3202
175124
52134
CHEMBL
CHEMBL193482
CompTox Database
DTXSID9022366
MetaboLights Database
MTBLS5148
MTBLS5132
MTBLS4012
MTBLS2871
MTBLS2406
MTBLS3487
MTBLS375
MTBLS4099
MTBLS3854
MTBLS4463
MTBLS2096
MTBLS2633
Protein Data Bank
1x8v
3q95
SABIO-RK Database
13888
SureChEMBL Database
SCHEMBL78033
UniProt Database
O35082
Q9TSL6
Q9GLD9
P06133
P16662
P15392
Rhea Database
RHEA:47332
RHEA:52472
RHEA:52468
HMDB Database
HMDB0000153
PDBeChem Database
ESL
Golm Database
723efcf8-0349-423f-b24e-2ba599941b47
2e4879f3-ba24-4b47-9c80-732a8cd2a4b4
VirtualMetabolicHuman Database
estriol
Patent number
EP1457490
EP1535618
EP1652535
EP1872775
EP1911454
EP1944041
US2003114431
US2005143366
US2007212427
US2007225263
US2007243217
US2007248556
US2007248658
US2007264309
WO2007124250
WO2007126938
WO2007131805
WO2007132215
EP1618886
Drug Central Database
3,187
BindingDB Database
50410506
KEGG DRUG Database
D00185
Reactom Database
R-HSA-9008258
R-HSA-9008267
R-HSA-9008270
R-HSA-9008271
R-HSA-9008285
R-HSA-9008315
R-HSA-9009526
R-HSA-9009533
R-HSA-9009536
R-HSA-9009541
R-HSA-9023859
R-HSA-9023860
R-HSA-9023861
R-HSA-9023884
VSDB Database
1,907
NURSA Database
10.1621/fDy1SSdcvK
CHEBI ID
CHEBI:27974
CHEBI:42467
CHEBI:4869
CHEBI:23969
PubChem SID
11533161
Properties
No Data Available
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Molecule Details
A 3-hydroxy steroid that is estra-1,3,5(10)-trien-3-ol substituted by additional hydroxy groups at positions 16 and 17 (16alpha,17beta-stereoisomer).
Molecular Spectra
No Data Available
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References
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