Cas no 19897-02-0 (Pregn-4-ene-3,20-dione,12-hydroxy-, (12a)-)
19897-02-0 structure
Product Name:Pregn-4-ene-3,20-dione,12-hydroxy-, (12a)-
CAS No:19897-02-0
MF:C21H30O3
MW:330.461106777191
CID:152151
PubChem ID:152266
Update Time:2025-04-19
Pregn-4-ene-3,20-dione,12-hydroxy-, (12a)- Chemical and Physical Properties
Names and Identifiers
-
- Pregn-4-ene-3,20-dione,12-hydroxy-, (12a)-
- (8R,9S,10R,12S,13S,14S,17S)-17-acetyl-12-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
- 12 alpha-hydroxyprogesterone
- (12alpha)-12-hydroxypregn-4-ene-3,20-dione
- 12alpha-Hydroxy-4-pregnene-3,20-dione
- 12alpha-hydroxypregn-4-ene-3,20-dione
- AC1L480T
- CHEBI:34153
- NSC60778
- SureCN6663711
- 8632QLR8C5
- DTXSID90941771
- SCHEMBL6663711
- LMST02030148
- 12-Hydroxypregn-4-ene-3,20-dione #
- Pregn-4-ene-3,20-dione, 12-hydroxy-, (12alpha)-
- PREGN-4-ENE-3,20-DIONE, 12-HYDROXY-, (12.ALPHA.)-
- 12-Hydroxypregn-4-ene-3,20-dione
- 12.ALPHA.-HYDROXY-4-PREGNENE-3,20-DIONE
- NSC 60778
- 19897-02-0
- UNII-8632QLR8C5
- 12alpha-Hydroxyprogesterone
- 12.ALPHA.-HYDROXYPROGESTERONE
- 12(alpha)-Hydroxyprogesterone
- NSC-60778
- PREGN-4-ENE-3,20-DIONE, 12.ALPHA.-HYDROXY-
- Q27115852
- GBYPMNXBNFQGAV-GCOKGBOCSA-N
-
- Inchi： 1S/C21H30O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)18(15)11-19(24)21(16,17)3/h10,15-19,24H,4-9,11H2,1-3H3/t15-,16+,17-,18-,19-,20-,21+/m0/s1
- InChI Key： GBYPMNXBNFQGAV-GCOKGBOCSA-N
- SMILES： O[C@H]1C[C@@H]2[C@@]3(C)CCC(C=C3CC[C@H]2[C@@H]2CC[C@H](C(C)=O)[C@]21C)=O
Computed Properties
- Exact Mass: 330.2196
- Monoisotopic Mass: 330.219495
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 1
- Complexity: 621
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 7
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.5
- Topological Polar Surface Area: 54.4
Experimental Properties
- Density: 1.15
- Boiling Point: 487.4°Cat760mmHg
- Flash Point: 262.7°C
- Refractive Index: 1.557
- PSA: 54.37
- LogP: 3.69430
Pregn-4-ene-3,20-dione,12-hydroxy-, (12a)- Related Literature
-
Jian Sun,Jun Liu,Ge Ren,Xiaotong Chen,Huahao Cai,Jinhai Hong,Juan Kan,Changhai Jin,Fuxiang Niu,Wenting Zhang RSC Adv. 2022 12 11376
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Caleb D. Vogt,Aaron G. Bart,Rahul Yadav,Emily E. Scott,Jeffrey Aubé Org. Biomol. Chem. 2021 19 7664
-
Kelei Li,Jiajing Jiang,Hailong Xiao,Kejian Wu,Ce Qi,Jin Sun,Duo Li Food Funct. 2018 9 5189
-
Kexin Chen,Chao Liu,Xian Zhang,Zhenghong Xu,Minglong Shao,Taowei Yang,Zhiming Rao Catal. Sci. Technol. 2023 13 548
-
Xiao-Dong Pan,Jian-Long Han Anal. Methods 2022 14 4146
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Gluco/mineralocorticoids, progestogins and derivatives
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Pregnane steroids Gluco/mineralocorticoids, progestogins and derivatives
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