Isocryptoxanthin
TL;DR: Isocryptoxanthin (CAS 472-62-8) is a chemical compound with molecular formula C40H56O and molecular weight 552.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-ol
Also Known As: isocryptoxanthin, beta-caroten-4-ol, beta,beta-caroten-4-ol, 4-hydroxy-beta-carotene, all-trans-Isocryptoxanthin
| Molecular Formula | C40H56O |
|---|---|
| Molecular Weight | 552.43 g/mol |
| LogP | 11.5766 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 552.4331 |
| Heavy Atoms | 41 |
| Complexity | 1251.3951 |
Chemical Identifiers
| CAS Number | 472-62-8 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C(CCC2(C)C)O)C)/C)/C |
Product Overview
Isocryptoxanthin (CAS 472-62-8), with molecular formula C40H56O and molecular weight 552.43 g/mol. IUPAC: 2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-ol.
Chemical Property Profile of Isocryptoxanthin
Property Insights of Isocryptoxanthin
The XLogP value of 11.5766 indicates that Isocryptoxanthin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, Isocryptoxanthin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isocryptoxanthin has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isocryptoxanthin?
The CAS number of Isocryptoxanthin is 472-62-8.
What is the molecular formula of Isocryptoxanthin?
The molecular formula of Isocryptoxanthin is C40H56O.
What is the molecular weight of Isocryptoxanthin?
The molecular weight of Isocryptoxanthin is 552.43 g/mol.
Where can I buy Isocryptoxanthin?
You can request a quote for Isocryptoxanthin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isocryptoxanthin?
Yes, KEHONG BIO provides custom synthesis services for Isocryptoxanthin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.