Naphthgeranine C
TL;DR: Naphthgeranine C (CAS 137109-45-6) is a chemical compound with molecular formula C20H20O7 and molecular weight 372.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4aS,12bR)-3,8,10-trihydroxy-2-(hydroxymethyl)-5,5-dimethyl-3,4,4a,12b-tetrahydronaphtho[2,3-c]isochromene-7,12-dione
Also Known As: Naphthgeranine C, Naphthgeranin C, (3S,4aS,12bR)-3,8,10-trihydroxy-2-(hydroxymethyl)-5,5-dimethyl-3,4,4a,12b-tetrahydronaphtho[2,3-c]isochromene-7,12-dione, 4H-Benzo(d)naphtho(2,3-b)pyran-7,12-dione, 3,4a,5,12b-tetrahydro-3,8,10-trihydroxy-2-(hydroxymethyl)-5,5-dimethyl-, (3S-(3alpha,4aalpha,12balpha))-, (3S)-4,4abeta,5,12bbeta-Tetrahydro-3beta,8,10-trihydroxy-2-(hydroxymethyl)-5,5-dimethyl-3H-benzo[d]naphtho[2,3-b]pyran-7,12-dione
| Molecular Formula | C20H20O7 |
|---|---|
| Molecular Weight | 372.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 372.1209 |
| Heavy Atoms | 27 |
| Complexity | 749.0 |
Chemical Identifiers
| CAS Number | 137109-45-6 |
|---|---|
| SMILES | CC1([C@H]2C[C@@H](C(=C[C@H]2C3=C(O1)C(=O)C4=C(C3=O)C=C(C=C4O)O)CO)O)C |
| InChIKey | SAUXNHFIRMCZCG-WXHSDQCUSA-N |
Product Overview
Naphthgeranine C (CAS 137109-45-6), with molecular formula C20H20O7 and molecular weight 372.12 g/mol. IUPAC: (3S,4aS,12bR)-3,8,10-trihydroxy-2-(hydroxymethyl)-5,5-dimethyl-3,4,4a,12b-tetrahydronaphtho[2,3-c]isochromene-7,12-dione.
Chemical Property Profile of Naphthgeranine C
Property Insights of Naphthgeranine C
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphthgeranine C. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphthgeranine C. Following Lipinski's Rule of Five, Naphthgeranine C has 4 hydrogen bond donor(s) and 7 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 Naphthgeranine C?
The CAS number of Naphthgeranine C is 137109-45-6.
What is the molecular formula of Naphthgeranine C?
The molecular formula of Naphthgeranine C is C20H20O7.
What is the molecular weight of Naphthgeranine C?
The molecular weight of Naphthgeranine C is 372.12 g/mol.
Where can I buy Naphthgeranine C?
You can request a quote for Naphthgeranine C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthgeranine C?
Yes, KEHONG BIO provides custom synthesis services for Naphthgeranine C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.