Alterporriol B
TL;DR: Alterporriol B (CAS 88901-69-3) is a chemical compound with molecular formula C32H26O13 and molecular weight 618.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dihydroxy-2-methoxy-7-methyl-1-[(5S,6R,7R,8R)-4,5,6,7,8-pentahydroxy-2-methoxy-7-methyl-9,10-dioxo-6,8-dihydro-5H-anthracen-1-yl]anthracene-9,10-dione
Also Known As: Alterporriol B, Ap-B 3, 4,6-dihydroxy-2-methoxy-7-methyl-1-[(5S,6R,7R,8R)-4,5,6,7,8-pentahydroxy-2-methoxy-7-methyl-9,10-dioxo-6,8-dihydro-5H-anthracen-1-yl]anthracene-9,10-dione, (1,1'-Bianthracene)-9,9',10,10'-tetrone, 5,6,7,8-tetrahydro-4,4',5,6,6',7,8-heptahydroxy-2,2'-dimethoxy-7,7'-dimethyl-, (5S-(5alpha,6beta,7beta,8alpha))-, (5S,6R,7R,8R)-4,4',5,6,6',7,8-Heptahydroxy-2,2'-dimethoxy-7,7'-dimethyl-5,6,7,8-tetrahydro[1,1'-bianthracene]-9,9',10,10'-tetrone
| Molecular Formula | C32H26O13 |
|---|---|
| Molecular Weight | 618.14 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 228.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 3 |
| Exact Mass | 618.1373 |
| Heavy Atoms | 45 |
| Complexity | 1310.0 |
Chemical Identifiers
| CAS Number | 88901-69-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1O)C(=O)C3=C(C2=O)C(=C(C=C3O)OC)C4=C(C=C(C5=C4C(=O)C6=C(C5=O)[C@@H]([C@H]([C@]([C@@H]6O)(C)O)O)O)O)OC |
| InChIKey | YHXUFRJJYFYRSH-SYEZAVJTSA-N |
Product Overview
Alterporriol B (CAS 88901-69-3), with molecular formula C32H26O13 and molecular weight 618.14 g/mol. IUPAC: 4,6-dihydroxy-2-methoxy-7-methyl-1-[(5S,6R,7R,8R)-4,5,6,7,8-pentahydroxy-2-methoxy-7-methyl-9,10-dioxo-6,8-dihydro-5H-anthracen-1-yl]anthracene-9,10-dione.
Chemical Property Profile of Alterporriol B
Property Insights of Alterporriol B
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alterporriol B. The TPSA of 228.0 Ų indicates high polarity, suggesting Alterporriol B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Alterporriol B has 7 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 Alterporriol B?
The CAS number of Alterporriol B is 88901-69-3.
What is the molecular formula of Alterporriol B?
The molecular formula of Alterporriol B is C32H26O13.
What is the molecular weight of Alterporriol B?
The molecular weight of Alterporriol B is 618.14 g/mol.
Where can I buy Alterporriol B?
You can request a quote for Alterporriol B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alterporriol B?
Yes, KEHONG BIO provides custom synthesis services for Alterporriol B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.