11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione
TL;DR: 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione (CAS 70094-60-9) is a chemical compound with molecular formula C21H30O5 and molecular weight 370.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7-tetratritio-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: hydrocortisone, [3h] cortisol, 1,2,6,7-(3H)Cortisol, Hydrocortisone-[1,2,6,7-3H(N)], HYDROCORTISONE, [1,2,6,7-3H]-
| Molecular Formula | C21H30O5 |
|---|---|
| Molecular Weight | 370.24 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.24222 |
| Heavy Atoms | 26 |
| Complexity | 684.0 |
Chemical Identifiers
| CAS Number | 70094-60-9 |
|---|---|
| SMILES | [3H]C1[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@]4(C(C(C(=O)C=C4C1[3H])[3H])[3H])C)O)C)(C(=O)CO)O |
| InChIKey | JYGXADMDTFJGBT-YPISDNQJSA-N |
Product Overview
11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione (CAS 70094-60-9), with molecular formula C21H30O5 and molecular weight 370.24 g/mol. IUPAC: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7-tetratritio-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione
Property Insights of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione. Following Lipinski's Rule of Five, 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione?
The CAS number of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione is 70094-60-9.
What is the molecular formula of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione?
The molecular formula of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione is C21H30O5.
What is the molecular weight of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione?
The molecular weight of 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione is 370.24 g/mol.
Where can I buy 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione?
You can request a quote for 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 11,17,21-Trihydroxy(1,2,6,7-~3~H_4_)pregn-4-ene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.