Rubomycin H
TL;DR: Rubomycin H (CAS 38942-79-9) is a chemical compound with molecular formula C29H31NO12 and molecular weight 585.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]carbamate
Also Known As: Rubomycin H, Daunomycin, N-carbmethoxy-, Daunorubicin, N-carbmethoxy-, Daunomycin,N-carbmethoxy, Daunomycin, methyl ester
| Molecular Formula | C29H31NO12 |
|---|---|
| Molecular Weight | 585.18 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 198.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 585.18463 |
| Heavy Atoms | 42 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 38942-79-9 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)C)O)NC(=O)OC)O |
| InChIKey | UREDLESXYCYDOH-UHFFFAOYSA-N |
Product Overview
Rubomycin H (CAS 38942-79-9), with molecular formula C29H31NO12 and molecular weight 585.18 g/mol. IUPAC: methyl N-[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]carbamate.
Chemical Property Profile of Rubomycin H
Property Insights of Rubomycin H
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rubomycin H. The TPSA of 198.0 Ų indicates high polarity, suggesting Rubomycin H may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Rubomycin H has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Rubomycin H?
The CAS number of Rubomycin H is 38942-79-9.
What is the molecular formula of Rubomycin H?
The molecular formula of Rubomycin H is C29H31NO12.
What is the molecular weight of Rubomycin H?
The molecular weight of Rubomycin H is 585.18 g/mol.
Where can I buy Rubomycin H?
You can request a quote for Rubomycin H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rubomycin H?
Yes, KEHONG BIO provides custom synthesis services for Rubomycin H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.