Beta,beta-carotene-3,3'-diol
TL;DR: Beta,beta-carotene-3,3'-diol (CAS 29472-68-2) is a chemical compound with molecular formula C40H56O2 and molecular weight 568.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol
Also Known As: Zeaxanthin, Anchovixanthin, (3R,3'S)-Zeaxanthin, meso-Zeaxanthin [M+H]+, b,b-Carotene-3,3'-diol
| Molecular Formula | C40H56O2 |
|---|---|
| Molecular Weight | 568.43 g/mol |
| LogP | 10.5474 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 568.42804 |
| Heavy Atoms | 42 |
| Complexity | 1188.559 |
Chemical Identifiers
| CAS Number | 29472-68-2 |
|---|---|
| SMILES | CC1=C(C(CC(C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(CC(CC2(C)C)O)C)\C)\C)/C)/C |
Product Overview
Beta,beta-carotene-3,3'-diol (CAS 29472-68-2), with molecular formula C40H56O2 and molecular weight 568.43 g/mol. IUPAC: 4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol.
Chemical Property Profile of Beta,beta-carotene-3,3'-diol
Property Insights of Beta,beta-carotene-3,3'-diol
The XLogP value of 10.5474 indicates that Beta,beta-carotene-3,3'-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, Beta,beta-carotene-3,3'-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Beta,beta-carotene-3,3'-diol has 2 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 Beta,beta-carotene-3,3'-diol?
The CAS number of Beta,beta-carotene-3,3'-diol is 29472-68-2.
What is the molecular formula of Beta,beta-carotene-3,3'-diol?
The molecular formula of Beta,beta-carotene-3,3'-diol is C40H56O2.
What is the molecular weight of Beta,beta-carotene-3,3'-diol?
The molecular weight of Beta,beta-carotene-3,3'-diol is 568.43 g/mol.
Where can I buy Beta,beta-carotene-3,3'-diol?
You can request a quote for Beta,beta-carotene-3,3'-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Beta,beta-carotene-3,3'-diol?
Yes, KEHONG BIO provides custom synthesis services for Beta,beta-carotene-3,3'-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.