Cas no 7323-86-6 (6-ketoestriol)
6-ketoestriol structure
Product Name:6-ketoestriol
CAS No:7323-86-6
MF:C18H22O4
MW:302.364885807037
CID:977916
PubChem ID:11876959
Update Time:2025-04-19
6-ketoestriol Chemical and Physical Properties
Names and Identifiers
-
- 6-ketoestriol
- 1,3,5(10)-ESTRATRIEN-3,16A,17B-TRIOL-6-ONE
- 6-oxo-estriol
- oestriol-6-one
- PYFIDTBVOMQKDC-XCYHEEQWSA-N
- 6-Oxoestratriol
- 6-oxo-16alpha,17beta-estriol
- Estra-1,3,5(10)-trien-6-one, 3,16,17-trihydroxy-, (16alpha,17beta)-
- DTXSID901317510
- (8R,9S,13S,14S,16R,17R)-3,16,17-trihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-one
- (16a,17b)-3,16,17-trihydroxy-Estra-1,3,5(10)-trien-6-one
- MH3UHG2T3V
- (16alpha,17beta)-3,16,17-Trihydroxyestra-1,3,5(10)-trien-6-one
- SCHEMBL4907038
- 6-Oxo-16a,17b-estriol
- CHEBI:145763
- 7323-86-6
- (1S,10R,11S,13R,14R,15S)-5,13,14-trihydroxy-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2,4,6-trien-8-one
- 6-Oxoestriol
- 3,16alpha,17beta-trihydroxyestra-1,3,5(10)-trien-6-one
- (1R,2R,3aS,3bR,9bS,11aS)-1,2,7-trihydroxy-11a-methyl-1,2,3,3a,3b,4,9b,10,11,11a-decahydro-5H-cyclopenta[a]phenanthren-5-one
- 6-Oxo-esterol
-
- Inchi： 1S/C18H22O4/c1-18-5-4-11-10-3-2-9(19)6-13(10)15(20)7-12(11)14(18)8-16(21)17(18)22/h2-3,6,11-12,14,16-17,19,21-22H,4-5,7-8H2,1H3/t11-,12-,14+,16-,17+,18+/m1/s1
- InChI Key： PYFIDTBVOMQKDC-XCYHEEQWSA-N
- SMILES： O[C@H]1[C@@H](C[C@H]2[C@@H]3CC(C4C=C(C=CC=4[C@H]3CC[C@@]21C)O)=O)O
Computed Properties
- Exact Mass: 302.15200
- Monoisotopic Mass: 302.15180918g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 0
- Complexity: 478
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 6
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 77.8?2
Experimental Properties
- PSA: 77.76000
- LogP: 2.22020
6-ketoestriol Related Literature
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
-
3. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
7323-86-6 (6-ketoestriol) Related Products
- 571-92-6(6-Keto 17b-Estradiol)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
Recommended suppliers
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Shenzhen Yaoyuan R&D Center Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier
CN Supplier
Reagent
