Cas no 10024-37-0 (Pregnan-20-one,3,11,18,21-tetrahydroxy-, (3a,5b,11b)- (9CI))
10024-37-0 structure
Product Name:Pregnan-20-one,3,11,18,21-tetrahydroxy-, (3a,5b,11b)- (9CI)
CAS No:10024-37-0
MF:C21H34O5
MW:366.49166727066
CID:160532
Update Time:2024-01-25
Pregnan-20-one,3,11,18,21-tetrahydroxy-, (3a,5b,11b)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Pregnan-20-one,3,11,18,21-tetrahydroxy-, (3a,5b,11b)- (9CI)
- 18-Hydroxytetrahydrocorticosterone
- 5b-Pregnan-20-one, 3a,11b,18,21-tetrahydroxy- (7CI,8CI)
- Pregnan-20-one, 3,11,18,21-tetrahydroxy-, (3α,5β,11β)-
-
- Inchi： 1S/C21H34O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h12-17,19,22-25H,2-11H2,1H3/t12-,13-,14+,15+,16-,17+,19-,20+,21-/m1/s1
- InChI Key： HCCUWLZXNRCUSV-RXKIGOLRSA-N
- SMILES： [C@H]1(O)C[C@]2([H])[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](C[C@@H]1O)(CO)[C@@H](C(=O)CO)CC3)CC2
Computed Properties
- Exact Mass: 366.24072
Experimental Properties
- Density: 1.240±0.06 g/cm3(Predicted)
- Boiling Point: 555.8±50.0 °C(Predicted)
- PSA: 97.99
- pka: 12.98±0.10(Predicted)
Pregnan-20-one,3,11,18,21-tetrahydroxy-, (3a,5b,11b)- (9CI) Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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