vitamin D3 palmitate
TL;DR: vitamin D3 palmitate (CAS 13403-10-6) is a chemical compound with molecular formula C43H74O2 and molecular weight 622.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl] hexadecanoate
Also Known As: Vitamin D3 palmitate, Cholecalciferol palmitate, [(1R,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl] hexadecanoate, (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatriene-3-yl hexadecanoate, 9,10-Secocholesta-5,7,10(19)-trien-3-ol, hexadecanoate, (3beta,5Z,7E)-
| Molecular Formula | C43H74O2 |
|---|---|
| Molecular Weight | 622.57 g/mol |
| LogP | 13.6512 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 21 |
| Exact Mass | 622.5689 |
| Heavy Atoms | 45 |
| Complexity | 924.12683 |
Chemical Identifiers
| CAS Number | 13403-10-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)O[C@@H]1CCC(=C)/C(=C\C=C\2/CCC[C@]3([C@H]2CC[C@@H]3[C@H](C)CCCC(C)C)C)/C1 |
Product Overview
vitamin D3 palmitate (CAS 13403-10-6), with molecular formula C43H74O2 and molecular weight 622.57 g/mol. IUPAC: [(1R,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl] hexadecanoate.
Chemical Property Profile of vitamin D3 palmitate
Property Insights of vitamin D3 palmitate
The XLogP value of 13.6512 indicates that vitamin D3 palmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, vitamin D3 palmitate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, vitamin D3 palmitate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of vitamin D3 palmitate?
The CAS number of vitamin D3 palmitate is 13403-10-6.
What is the molecular formula of vitamin D3 palmitate?
The molecular formula of vitamin D3 palmitate is C43H74O2.
What is the molecular weight of vitamin D3 palmitate?
The molecular weight of vitamin D3 palmitate is 622.57 g/mol.
Where can I buy vitamin D3 palmitate?
You can request a quote for vitamin D3 palmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for vitamin D3 palmitate?
Yes, KEHONG BIO provides custom synthesis services for vitamin D3 palmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.