Baumycin B2
TL;DR: Baumycin B2 (CAS 64253-72-1) is a chemical compound with molecular formula C34H41NO14 and molecular weight 687.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(2S,3S,4S,6R)-6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-4-amino-2-methyloxan-3-yl]oxy-3-hydroxybutoxy]propanoic acid
Also Known As: Baumycin B2, Baumycin B1, (8S-cis)-8-Acetyl-10-((3-amino-4-O-(1-(1-carboxyethoxy)-3-hydroxybutyl)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,9,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione, 5,12-Naphthacenedione, 8-acetyl-10-((3-amino-4-O-(1-(1-carboxyethoxy)-3-hydroxybutyl)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,9,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, (8S-cis)-, (8s)-8-acetyl-10alpha-[[3-amino-4-o-[1-(1-carboxyethoxy)-3-hydroxybutyl]-2,3,6-trideoxy-alpha-l-lyxo-hexopyranosyl]oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione
| Molecular Formula | C34H41NO14 |
|---|---|
| Molecular Weight | 687.25 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 242.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Exact Mass | 687.2527 |
| Heavy Atoms | 49 |
| Complexity | 1250.0 |
Chemical Identifiers
| CAS Number | 64253-72-1 |
|---|---|
| SMILES | C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)C)O)N)OC(CC(C)O)OC(C)C(=O)O |
| InChIKey | FEMNWPQDEXLDKE-WDLAWJQVSA-N |
Product Overview
Baumycin B2 (CAS 64253-72-1), with molecular formula C34H41NO14 and molecular weight 687.25 g/mol. IUPAC: 2-[1-[(2S,3S,4S,6R)-6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-4-amino-2-methyloxan-3-yl]oxy-3-hydroxybutoxy]propanoic acid.
Chemical Property Profile of Baumycin B2
Property Insights of Baumycin B2
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Baumycin B2. The TPSA of 242.0 Ų indicates high polarity, suggesting Baumycin B2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Baumycin B2 has 6 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Baumycin B2?
The CAS number of Baumycin B2 is 64253-72-1.
What is the molecular formula of Baumycin B2?
The molecular formula of Baumycin B2 is C34H41NO14.
What is the molecular weight of Baumycin B2?
The molecular weight of Baumycin B2 is 687.25 g/mol.
Where can I buy Baumycin B2?
You can request a quote for Baumycin B2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Baumycin B2?
Yes, KEHONG BIO provides custom synthesis services for Baumycin B2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.