Pheophytin a
TL;DR: Pheophytin a (CAS 603-17-8) is a chemical compound with molecular formula C55H74N4O5 and molecular weight 870.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 16-ethenyl-11-ethyl-4-hydroxy-12,17,21,26-tetramethyl-22-[3-oxo-3-(3,7,11,15-tetramethylhexadec-2-enoxy)propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylate
Also Known As: Pheophytin a, chlorophyll a, Methyl 16-ethenyl-11-ethyl-4-hydroxy-12,17,21,26-tetramethyl-22-[3-oxo-3-(3,7,11,15-tetramethylhexadec-2-enoxy)propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylate, PHEOPHYTIN A;,11s),4beta,21beta]]-;ramethyl-20-oxo-,3,7,11,15-tetramethyl-2-hexadecenylester,[3s-[3alpha(2e,7s;3,7,11,15-tetramethylhexadec-2-en-1-yl [3S-[3alpha(2E,7S*,11S*),4beta,21beta]]-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionate;PHENOPHYTINA;PHEOPHORBIDE A (SH);PHEOPHYTHIN A
| Molecular Formula | C55H74N4O5 |
|---|---|
| Molecular Weight | 870.57 g/mol |
| LogP | 11.7 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 22 |
| Exact Mass | 870.5659 |
| Heavy Atoms | 64 |
| Complexity | 2300.0 |
Chemical Identifiers
| CAS Number | 603-17-8 |
|---|---|
| SMILES | CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C5C(C(C(=CC6=NC(=C2)C(=C6C)C=C)N5)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(=O)OC)O)C)C |
| InChIKey | FDHFJXKRMIVNCQ-UHFFFAOYSA-N |
Product Overview
Pheophytin a (CAS 603-17-8), with molecular formula C55H74N4O5 and molecular weight 870.57 g/mol. IUPAC: methyl 16-ethenyl-11-ethyl-4-hydroxy-12,17,21,26-tetramethyl-22-[3-oxo-3-(3,7,11,15-tetramethylhexadec-2-enoxy)propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylate.
Chemical Property Profile of Pheophytin a
Property Insights of Pheophytin a
The XLogP value of 11.7 indicates that Pheophytin a is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pheophytin a. Following Lipinski's Rule of Five, Pheophytin a has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pheophytin a?
The CAS number of Pheophytin a is 603-17-8.
What is the molecular formula of Pheophytin a?
The molecular formula of Pheophytin a is C55H74N4O5.
What is the molecular weight of Pheophytin a?
The molecular weight of Pheophytin a is 870.57 g/mol.
Where can I buy Pheophytin a?
You can request a quote for Pheophytin a directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pheophytin a?
Yes, KEHONG BIO provides custom synthesis services for Pheophytin a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.