Mulberrofuran F
TL;DR: Mulberrofuran F (CAS 89200-00-0) is a chemical compound with molecular formula C39H34O8 and molecular weight 630.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9R,13R,21S)-1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol
Also Known As: Mulberrofuran F, (1S,9R,13R,21S)-1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol, (1S,9R,13R,21S)-1-(2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo(11.7.1.03,8.09,21.014,19)henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol, (3aR,8aS,13bR,13cS)-8a-[2,4-Dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-6-(6-hydroxy-1-benzofuran-2-yl)-2-methyl-1,8a,13b,13c-tetrahydro-3aH-benzo[c][1]benzopyrano[4,3,2-ij][2]benzopyran-4,11-diol, RefChem:160001
| Molecular Formula | C39H34O8 |
|---|---|
| Molecular Weight | 630.23 g/mol |
| LogP | 8.6079 |
| Topological Polar Surface Area | 132.75 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 630.22534 |
| Heavy Atoms | 47 |
| Complexity | 2167.9026 |
Chemical Identifiers
| CAS Number | 89200-00-0 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@@H]3[C@@H](C1)C4=C(C=C(C=C4)O)O[C@@]3(OC5=CC(=CC(=C25)O)C6=CC7=C(O6)C=C(C=C7)O)C8=C(C(=C(C=C8)O)CC=C(C)C)O |
Product Overview
Mulberrofuran F (CAS 89200-00-0), with molecular formula C39H34O8 and molecular weight 630.23 g/mol. IUPAC: (1S,9R,13R,21S)-1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol.
Chemical Property Profile of Mulberrofuran F
Property Insights of Mulberrofuran F
The XLogP value of 8.6079 indicates that Mulberrofuran F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Mulberrofuran F. Following Lipinski's Rule of Five, Mulberrofuran F has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mulberrofuran F?
The CAS number of Mulberrofuran F is 89200-00-0.
What is the molecular formula of Mulberrofuran F?
The molecular formula of Mulberrofuran F is C39H34O8.
What is the molecular weight of Mulberrofuran F?
The molecular weight of Mulberrofuran F is 630.23 g/mol.
Where can I buy Mulberrofuran F?
You can request a quote for Mulberrofuran F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mulberrofuran F?
Yes, KEHONG BIO provides custom synthesis services for Mulberrofuran F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.