25-Hydroxyvitamin D2-25-glucuronide
TL;DR: 25-Hydroxyvitamin D2-25-glucuronide (CAS 76020-77-4) is a chemical compound with molecular formula C34H52O8 and molecular weight 588.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-[(E,3S,6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-(5-hydroxy-2-methylidenecyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2,3-dimethylhept-4-en-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: 25-Hvd2-25-gur, 25-Hydroxyvitamin D2-25-glucuronide, 25-Hydroxyergocalciferol-25-glucuronide, 25-hydroxyvitamin D2-25-glucuronoside, (2S,3S,4S,5R,6S)-6-[(E,3S,6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-(5-hydroxy-2-methylidenecyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2,3-dimethylhept-4-en-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
| Molecular Formula | C34H52O8 |
|---|---|
| Molecular Weight | 588.37 g/mol |
| LogP | 4.6724 |
| Topological Polar Surface Area | 136.68 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 588.3662 |
| Heavy Atoms | 42 |
| Complexity | 1091.1001 |
Chemical Identifiers
| CAS Number | 76020-77-4 |
|---|---|
| SMILES | C[C@H](/C=C/[C@H](C)C(C)(C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)[C@H]2CCC\3[C@@]2(CCC/C3=C\C=C/4\CC(CCC4=C)O)C |
Product Overview
25-Hydroxyvitamin D2-25-glucuronide (CAS 76020-77-4), with molecular formula C34H52O8 and molecular weight 588.37 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-[(E,3S,6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-(5-hydroxy-2-methylidenecyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2,3-dimethylhept-4-en-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of 25-Hydroxyvitamin D2-25-glucuronide
Property Insights of 25-Hydroxyvitamin D2-25-glucuronide
The XLogP value of 4.6724 indicates that 25-Hydroxyvitamin D2-25-glucuronide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 25-Hydroxyvitamin D2-25-glucuronide. Following Lipinski's Rule of Five, 25-Hydroxyvitamin D2-25-glucuronide has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 25-Hydroxyvitamin D2-25-glucuronide?
The CAS number of 25-Hydroxyvitamin D2-25-glucuronide is 76020-77-4.
What is the molecular formula of 25-Hydroxyvitamin D2-25-glucuronide?
The molecular formula of 25-Hydroxyvitamin D2-25-glucuronide is C34H52O8.
What is the molecular weight of 25-Hydroxyvitamin D2-25-glucuronide?
The molecular weight of 25-Hydroxyvitamin D2-25-glucuronide is 588.37 g/mol.
Where can I buy 25-Hydroxyvitamin D2-25-glucuronide?
You can request a quote for 25-Hydroxyvitamin D2-25-glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 25-Hydroxyvitamin D2-25-glucuronide?
Yes, KEHONG BIO provides custom synthesis services for 25-Hydroxyvitamin D2-25-glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.