Palmarumycin C3
TL;DR: Palmarumycin C3 (CAS 159934-11-9) is a chemical compound with molecular formula C20H12O6 and molecular weight 348.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1aR,7aS)-3,6-dihydroxyspiro[1a,7a-dihydronaphtho[2,3-b]oxirene-2,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-7-one
Also Known As: Palmarumycin C3, palmarumycins C3, HY-N10263, (1aR,7aS)-3,6-dihydroxyspiro[1a,7a-dihydronaphtho[2,3-b]oxirene-2,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-7-one, (1aR,7aS)-1a,7a-Dihydro-3,6-dihydroxyspiro[naphth[2,3-b]oxirene-2(7H),2'-naphtho[1,8-de][1,3]dioxin]-7-one; Spiro[naphtho[1,8-de]-1,3-dioxin-2,2'(7'H)-naphth[2,3-b]oxiren]-7'-one, 1'a,7'a-dihydro-3',6'-dihydroxy-, (1'aR,7'aS); Palmarumycin C3
| Molecular Formula | C20H12O6 |
|---|---|
| Molecular Weight | 348.06 g/mol |
| LogP | 2.8389 |
| Topological Polar Surface Area | 88.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 348.0634 |
| Heavy Atoms | 26 |
| Complexity | 1093.8447 |
Chemical Identifiers
| CAS Number | 159934-11-9 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)OC4([C@H]5[C@H](O5)C(=O)C6=C(C=CC(=C64)O)O)OC3=CC=C2 |
Product Overview
Palmarumycin C3 (CAS 159934-11-9), with molecular formula C20H12O6 and molecular weight 348.06 g/mol. IUPAC: (1aR,7aS)-3,6-dihydroxyspiro[1a,7a-dihydronaphtho[2,3-b]oxirene-2,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-7-one.
Chemical Property Profile of Palmarumycin C3
Property Insights of Palmarumycin C3
The XLogP value of 2.8389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Palmarumycin C3. The TPSA of 88.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Palmarumycin C3. Following Lipinski's Rule of Five, Palmarumycin C3 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Palmarumycin C3?
The CAS number of Palmarumycin C3 is 159934-11-9.
What is the molecular formula of Palmarumycin C3?
The molecular formula of Palmarumycin C3 is C20H12O6.
What is the molecular weight of Palmarumycin C3?
The molecular weight of Palmarumycin C3 is 348.06 g/mol.
Where can I buy Palmarumycin C3?
You can request a quote for Palmarumycin C3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Palmarumycin C3?
Yes, KEHONG BIO provides custom synthesis services for Palmarumycin C3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.