Daphnodorin C
TL;DR: Daphnodorin C (CAS 95733-04-3) is a chemical compound with molecular formula C30H22O9 and molecular weight 526.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,2'S,8'S)-4,5',6-trihydroxy-2',8'-bis(4-hydroxyphenyl)spiro[1-benzofuran-2,9'-2,3,4,8-tetrahydrofuro[2,3-h]chromene]-3-one
Also Known As: Daphnodorin C, Furobenzopyran deriv., (2S,2'S,8'S)-4,5',6-trihydroxy-2',8'-bis(4-hydroxyphenyl)spiro[1-benzofuran-2,9'-2,3,4,8-tetrahydrofuro[2,3-h]chromene]-3-one, (2S,2'S,8'S)-4,5',6-Trihydroxy-2',8'-bis(4-hydroxyphenyl)-3',4'-dihydro-2'H,3H,8'H-spiro[[1]benzofuran-2,9'-furo[2,3-h][1]benzopyran]-3-one, (2S,2'S,8'S)-4,5',6-trihydroxy-2',8'-bis(4-hydroxyphenyl)-3',4'-dihydro-2'H,3H-spiro[1-benzofuran-2,9'-furo[2,3-h]chromen]-3-one
| Molecular Formula | C30H22O9 |
|---|---|
| Molecular Weight | 526.13 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 526.1264 |
| Heavy Atoms | 39 |
| Complexity | 914.0 |
Chemical Identifiers
| CAS Number | 95733-04-3 |
|---|---|
| SMILES | C1CC2=C(C3=C(C=C2O)O[C@H]([C@]34C(=O)C5=C(C=C(C=C5O4)O)O)C6=CC=C(C=C6)O)O[C@@H]1C7=CC=C(C=C7)O |
| InChIKey | ISQNBCHHDNWNEQ-TVNVSJRUSA-N |
Product Overview
Daphnodorin C (CAS 95733-04-3), with molecular formula C30H22O9 and molecular weight 526.13 g/mol. IUPAC: (2S,2'S,8'S)-4,5',6-trihydroxy-2',8'-bis(4-hydroxyphenyl)spiro[1-benzofuran-2,9'-2,3,4,8-tetrahydrofuro[2,3-h]chromene]-3-one.
Chemical Property Profile of Daphnodorin C
Property Insights of Daphnodorin C
The XLogP value of 4.9 indicates that Daphnodorin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting Daphnodorin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Daphnodorin C has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Daphnodorin C?
The CAS number of Daphnodorin C is 95733-04-3.
What is the molecular formula of Daphnodorin C?
The molecular formula of Daphnodorin C is C30H22O9.
What is the molecular weight of Daphnodorin C?
The molecular weight of Daphnodorin C is 526.13 g/mol.
Where can I buy Daphnodorin C?
You can request a quote for Daphnodorin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Daphnodorin C?
Yes, KEHONG BIO provides custom synthesis services for Daphnodorin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.