Phytochromobilin
TL;DR: Phytochromobilin (CAS 143392-71-6) is a chemical compound with molecular formula C33H36N4O6 and molecular weight 584.2635 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2E,5Z)-2-[[4-(2-carboxyethyl)-5-[(Z)-[(3Z,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl]-3-methyl-1H-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-3-methyl-5-oxopyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid
Also Known As: Phytochromobilin, 3-[(2E,5Z)-2-[[4-(2-carboxyethyl)-5-[(Z)-[(3Z,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl]-3-methyl-1H-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-3-methyl-5-oxopyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid, 21H-Biline-8,12-dipropanoic acid, 18-ethenyl-3-ethylidene-1,2,3,19,22,24-hexahydro-2,7,13,17-tetramethyl-1,19-dioxo-, (2R,3E)-
Technical Specifications
| Molecular Formula | C33H36N4O6 |
| Molecular Weight | 584.2635 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 584.2635 Da |
| Heavy Atoms | 43 |
| Complexity | 1490.0 |
| SMILES | C/C=C\1/[C@H](C(=O)N/C1=C\C2=C(C(=C(N2)/C=C/3\C(=C(/C(=C/C4=NC(=O)C(=C4C)C=C)/N3)C)CCC(=O)O)C)CCC(=O)O)C |
| InChIKey | BJHKOBMQJMHRHS-SBEGJXMUSA-N |
Chemical Property Profile of Phytochromobilin
Property Insights of Phytochromobilin
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phytochromobilin. The TPSA of 161.0 Ų indicates high polarity, suggesting Phytochromobilin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phytochromobilin has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Phytochromobilin?
The CAS number of Phytochromobilin is 143392-71-6.
What is the molecular formula of Phytochromobilin?
The molecular formula of Phytochromobilin is C33H36N4O6.
What is the molecular weight of Phytochromobilin?
The molecular weight of Phytochromobilin is 584.2635 g/mol.
Where can I buy Phytochromobilin?
You can request a quote for Phytochromobilin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phytochromobilin?
Yes, CoreyChem provides custom synthesis services for Phytochromobilin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.