rac-Phycocyanobilin
TL;DR: rac-Phycocyanobilin (CAS 215871-76-4) is a chemical compound with molecular formula C33H38N4O6 and molecular weight 586.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2Z,5Z)-2-[[3-(2-carboxyethyl)-5-[(Z)-[(3E)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-2-yl]methylidene]-5-[(4-ethyl-3-methyl-5-oxopyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid
Also Known As: rac-Phycocyanobilin, Extracted from algae, 3-[(2Z,5Z)-2-[[3-(2-carboxyethyl)-5-[(Z)-[(3E)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-2-yl]methylidene]-5-[(4-ethyl-3-methyl-5-oxopyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid
| Molecular Formula | C33H38N4O6 |
|---|---|
| Molecular Weight | 586.28 g/mol |
| LogP | 3.36414 |
| Topological Polar Surface Area | 164.71 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 586.2791 |
| Heavy Atoms | 43 |
| Complexity | 1776.8376 |
Chemical Identifiers
| CAS Number | 215871-76-4 |
|---|---|
| SMILES | CCC1=C(C(=NC1=O)/C=C\2/C(=C(/C(=C/C3=C(C(=C(N3)/C=C\4/C(=C/C)/C(C(=O)N4)C)C)CCC(=O)O)/N2)CCC(=O)O)C)C |
Product Overview
rac-Phycocyanobilin (CAS 215871-76-4), with molecular formula C33H38N4O6 and molecular weight 586.28 g/mol. IUPAC: 3-[(2Z,5Z)-2-[[3-(2-carboxyethyl)-5-[(Z)-[(3E)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-2-yl]methylidene]-5-[(4-ethyl-3-methyl-5-oxopyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid.
Chemical Property Profile of rac-Phycocyanobilin
Property Insights of rac-Phycocyanobilin
The XLogP value of 3.36414 indicates that rac-Phycocyanobilin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 164.71 Ų indicates high polarity, suggesting rac-Phycocyanobilin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, rac-Phycocyanobilin has 5 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of rac-Phycocyanobilin?
The CAS number of rac-Phycocyanobilin is 215871-76-4.
What is the molecular formula of rac-Phycocyanobilin?
The molecular formula of rac-Phycocyanobilin is C33H38N4O6.
What is the molecular weight of rac-Phycocyanobilin?
The molecular weight of rac-Phycocyanobilin is 586.28 g/mol.
Where can I buy rac-Phycocyanobilin?
You can request a quote for rac-Phycocyanobilin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rac-Phycocyanobilin?
Yes, KEHONG BIO provides custom synthesis services for rac-Phycocyanobilin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.