甲基脱镁叶绿酸-a-(己基醚)
TL;DR: 甲基脱镁叶绿酸-a-(己基醚) (CAS 128146-77-0) is a chemical compound with molecular formula C42H52N4O6 and molecular weight 708.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基脱镁叶绿酸-a-(己基醚)
methyl (3R,21S,22S)-11-ethyl-16-(1-hexoxyethyl)-4-hydroxy-22-(3-methoxy-3-oxopropyl)-12,17,21,26-tetramethyl-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: MP-A-6E, Methylpheophorbide-a-(hexyl-ether), J1.126.435B, Methyl 14-ethyl-9-(1-(hexyloxy)ethyl)-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoate, (32R)-2,8alpha,12,17-Tetramethyl-31-oxo-32alpha-(methoxycarbonyl)-13-[1-(hexyloxy)ethyl]-18-ethyl-31,32,7,8-tetrahydro-21H,23H-cyclopenta[cd]porphyrin-7beta-propionic acid methyl ester
| Molecular Formula | C42H52N4O6 |
|---|---|
| Molecular Weight | 708.39 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 14 |
| Exact Mass | 708.3887 |
| Heavy Atoms | 52 |
| Complexity | 1940.0 |
Chemical Identifiers
| CAS Number | 128146-77-0 |
|---|---|
| SMILES | CCCCCCOC(C)C1=C(C2=NC1=CC3=NC(=CC4=C(C5=C([C@@H](C(=C6[C@H]([C@@H](C(=C2)N6)C)CCC(=O)OC)C5=N4)C(=O)OC)O)C)C(=C3C)CC)C |
| InChIKey | OBPWZPBWNINZPI-RAECGGCMSA-N |
Product Overview
甲基脱镁叶绿酸-a-(己基醚) (CAS 128146-77-0), with molecular formula C42H52N4O6 and molecular weight 708.39 g/mol. IUPAC: methyl (3R,21S,22S)-11-ethyl-16-(1-hexoxyethyl)-4-hydroxy-22-(3-methoxy-3-oxopropyl)-12,17,21,26-tetramethyl-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 甲基脱镁叶绿酸-a-(己基醚)
Property Insights of 甲基脱镁叶绿酸-a-(己基醚)
The XLogP value of 4.7 indicates that 甲基脱镁叶绿酸-a-(己基醚) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 甲基脱镁叶绿酸-a-(己基醚). Following Lipinski's Rule of Five, 甲基脱镁叶绿酸-a-(己基醚) has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 甲基脱镁叶绿酸-a-(己基醚)?
The CAS number of 甲基脱镁叶绿酸-a-(己基醚) is 128146-77-0.
What is the molecular formula of 甲基脱镁叶绿酸-a-(己基醚)?
The molecular formula of 甲基脱镁叶绿酸-a-(己基醚) is C42H52N4O6.
What is the molecular weight of 甲基脱镁叶绿酸-a-(己基醚)?
The molecular weight of 甲基脱镁叶绿酸-a-(己基醚) is 708.39 g/mol.
Where can I buy 甲基脱镁叶绿酸-a-(己基醚)?
You can request a quote for 甲基脱镁叶绿酸-a-(己基醚) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基脱镁叶绿酸-a-(己基醚)?
Yes, KEHONG BIO provides custom synthesis services for 甲基脱镁叶绿酸-a-(己基醚) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.