Nogalarol
TL;DR: Nogalarol (CAS 11052-70-3) is a chemical compound with molecular formula C29H31NO12 and molecular weight 585.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 23-(dimethylamino)-4,8,10,12,22,24-hexahydroxy-1,12-dimethyl-6,17-dioxo-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-13-carboxylate
Also Known As: Nogalarol, Nogalamycin compound A, Compound A from Nogalamycin, NCI60_041901, U-24489
| Molecular Formula | C29H31NO12 |
|---|---|
| Molecular Weight | 585.18 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 204.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 3 |
| Exact Mass | 585.18463 |
| Heavy Atoms | 42 |
| Complexity | 1150.0 |
Chemical Identifiers
| CAS Number | 11052-70-3 |
|---|---|
| SMILES | CC1(CC(C2=C(C3=C(C=C2C1C(=O)OC)C(=O)C4=C5C(=CC(=C4C3=O)O)C6(C(C(C(C(O5)O6)O)N(C)C)O)C)O)O)O |
| InChIKey | UEAXJNKEWITCAW-UHFFFAOYSA-N |
Product Overview
Nogalarol (CAS 11052-70-3), with molecular formula C29H31NO12 and molecular weight 585.18 g/mol. IUPAC: methyl 23-(dimethylamino)-4,8,10,12,22,24-hexahydroxy-1,12-dimethyl-6,17-dioxo-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-13-carboxylate.
Chemical Property Profile of Nogalarol
Property Insights of Nogalarol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nogalarol. The TPSA of 204.0 Ų indicates high polarity, suggesting Nogalarol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nogalarol has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nogalarol?
The CAS number of Nogalarol is 11052-70-3.
What is the molecular formula of Nogalarol?
The molecular formula of Nogalarol is C29H31NO12.
What is the molecular weight of Nogalarol?
The molecular weight of Nogalarol is 585.18 g/mol.
Where can I buy Nogalarol?
You can request a quote for Nogalarol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nogalarol?
Yes, KEHONG BIO provides custom synthesis services for Nogalarol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.