Hitachimycin
TL;DR: Hitachimycin (CAS 77642-19-4) is a chemical compound with molecular formula C29H35NO5 and molecular weight 477.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16,20-dihydroxy-21-methoxy-3-methyl-10-phenyl-9-azabicyclo[17.3.0]docosa-2,4,6,12,19-pentaene-8,18-dione
Also Known As: Hitachimycin, Stubomycin, 16,20-dihydroxy-21-methoxy-3-methyl-10-phenyl-9-azabicyclo[17.3.0]docosa-2,4,6,12,19-pentaene-8,18-dione
| Molecular Formula | C29H35NO5 |
|---|---|
| Molecular Weight | 477.25 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 95.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 477.25153 |
| Heavy Atoms | 35 |
| Complexity | 891.0 |
Chemical Identifiers
| CAS Number | 77642-19-4 |
|---|---|
| SMILES | CC1=CC2CC(C(=C2C(=O)CC(CCC=CCC(NC(=O)C=CC=C1)C3=CC=CC=C3)O)O)OC |
| InChIKey | PLQKHNPZPRTISL-UHFFFAOYSA-N |
Product Overview
Hitachimycin (CAS 77642-19-4), with molecular formula C29H35NO5 and molecular weight 477.25 g/mol. IUPAC: 16,20-dihydroxy-21-methoxy-3-methyl-10-phenyl-9-azabicyclo[17.3.0]docosa-2,4,6,12,19-pentaene-8,18-dione.
Chemical Property Profile of Hitachimycin
Property Insights of Hitachimycin
The XLogP value of 4.0 indicates that Hitachimycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Hitachimycin. Following Lipinski's Rule of Five, Hitachimycin has 3 hydrogen bond donor(s) and 5 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 Hitachimycin?
The CAS number of Hitachimycin is 77642-19-4.
What is the molecular formula of Hitachimycin?
The molecular formula of Hitachimycin is C29H35NO5.
What is the molecular weight of Hitachimycin?
The molecular weight of Hitachimycin is 477.25 g/mol.
Where can I buy Hitachimycin?
You can request a quote for Hitachimycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hitachimycin?
Yes, KEHONG BIO provides custom synthesis services for Hitachimycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.