Baumycin C1
TL;DR: Baumycin C1 (CAS 63084-42-4) is a chemical compound with molecular formula C28H29NO11 and molecular weight 555.1741 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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]formamide
Also Known As: Baumycin C1, N-Formyldaunorubicin, 5,12-Naphthacenedione, 8-acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-(formylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-, (8S-cis)-, 3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-(formylamino)hexopyranoside, 5,12-Naphthacenedione, 8-acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-[[2,3,6-trideoxy-3-(formylamino)-.alpha.-L-lyxo-hexopyranosyl]oxy]-, (8S-cis)-
Technical Specifications
| Molecular Formula | C28H29NO11 |
| Molecular Weight | 555.1741 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 189.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 555.1741 Da |
| Heavy Atoms | 40 |
| Complexity | 1020.0 |
| 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)O |
| InChIKey | AQFSEUJDYAJBPS-UHFFFAOYSA-N |
Chemical Property Profile of Baumycin C1
Property Insights of Baumycin C1
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Baumycin C1. The TPSA of 189.0 Ų indicates high polarity, suggesting Baumycin C1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Baumycin C1 has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Baumycin C1?
The CAS number of Baumycin C1 is 63084-42-4.
What is the molecular formula of Baumycin C1?
The molecular formula of Baumycin C1 is C28H29NO11.
What is the molecular weight of Baumycin C1?
The molecular weight of Baumycin C1 is 555.1741 g/mol.
Where can I buy Baumycin C1?
You can request a quote for Baumycin C1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Baumycin C1?
Yes, CoreyChem provides custom synthesis services for Baumycin C1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.