Component CAS registry number(s): 75-31-0
TL;DR: Component CAS registry number(s): 75-31-0 (CAS 6742-26-3) is a chemical compound with molecular formula C30H37NO11 and molecular weight 587.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-5-oxopentanoic acid;propan-2-amine
Also Known As: Component CAS registry number(s): 75-31-0, Podophyllotoxin, compd. with isopropylamine, Naphthalene,1,5-dimethyl-2,4,6,8-tetranitro, Glutaric acid (8CI), compd. with isopropylamine (1:1), 5-oxo-5-{[(5r,5ar,8ar,9r)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl]oxy}pentanoic acid- propan-2-amine(1:1)
| Molecular Formula | C30H37NO11 |
|---|---|
| Molecular Weight | 587.24 g/mol |
| LogP | 3.5685 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 587.23663 |
| Heavy Atoms | 42 |
| Complexity | 876.0 |
Chemical Identifiers
| CAS Number | 6742-26-3 |
|---|---|
| SMILES | CC(C)N.COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)OC(=O)CCCC(=O)O |
| InChIKey | LKMCLFHVHHDDRL-UFOIAZTESA-N |
Product Overview
Component CAS registry number(s): 75-31-0 (CAS 6742-26-3), with molecular formula C30H37NO11 and molecular weight 587.24 g/mol. IUPAC: 5-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-5-oxopentanoic acid;propan-2-amine.
Chemical Property Profile of Component CAS registry number(s): 75-31-0
Property Insights of Component CAS registry number(s): 75-31-0
The XLogP value of 3.5685 indicates that Component CAS registry number(s): 75-31-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.0 Ų indicates high polarity, suggesting Component CAS registry number(s): 75-31-0 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Component CAS registry number(s): 75-31-0 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Component CAS registry number(s): 75-31-0?
The CAS number of Component CAS registry number(s): 75-31-0 is 6742-26-3.
What is the molecular formula of Component CAS registry number(s): 75-31-0?
The molecular formula of Component CAS registry number(s): 75-31-0 is C30H37NO11.
What is the molecular weight of Component CAS registry number(s): 75-31-0?
The molecular weight of Component CAS registry number(s): 75-31-0 is 587.24 g/mol.
Where can I buy Component CAS registry number(s): 75-31-0?
You can request a quote for Component CAS registry number(s): 75-31-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Component CAS registry number(s): 75-31-0?
Yes, KEHONG BIO provides custom synthesis services for Component CAS registry number(s): 75-31-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.