harringtonine
TL;DR: harringtonine (CAS 64190-48-3) is a chemical compound with molecular formula C28H37NO9 and molecular weight 531.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-[(2S,3S)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl 2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate
Also Known As: harringtonine, 1-O-[(2S,3S)-4-Methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl 2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate, o3-[2,5-dihydroxy-2-(2-methoxy-2-oxoethyl)-5-methylhexanoyl]cephalotaxine, Cephalotaxine, 4-methyl-2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate (ester), O~3~-[2,5-Dihydroxy-2-(2-methoxy-2-oxoethyl)-5-methylhexanoyl]cephalotaxine
| Molecular Formula | C28H37NO9 |
|---|---|
| Molecular Weight | 531.25 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 531.2468 |
| Heavy Atoms | 38 |
| Complexity | 953.0 |
Chemical Identifiers
| CAS Number | 64190-48-3 |
|---|---|
| SMILES | CC(C)(CCC(CC(=O)OC)(C(=O)O[C@H]1[C@H]2C3=CC4=C(C=C3CCN5C2(CCC5)C=C1OC)OCO4)O)O |
| InChIKey | HAVJATCHLFRDHY-QULSYZCUSA-N |
Product Overview
harringtonine (CAS 64190-48-3), with molecular formula C28H37NO9 and molecular weight 531.25 g/mol. IUPAC: 1-O-[(2S,3S)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl 2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate.
Chemical Property Profile of harringtonine
Property Insights of harringtonine
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for harringtonine. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for harringtonine. Following Lipinski's Rule of Five, harringtonine has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of harringtonine?
The CAS number of harringtonine is 64190-48-3.
What is the molecular formula of harringtonine?
The molecular formula of harringtonine is C28H37NO9.
What is the molecular weight of harringtonine?
The molecular weight of harringtonine is 531.25 g/mol.
Where can I buy harringtonine?
You can request a quote for harringtonine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for harringtonine?
Yes, KEHONG BIO provides custom synthesis services for harringtonine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.