磷酸丝裂霉素
TL;DR: 磷酸丝裂霉素 (CAS 124580-38-7) is a chemical compound with molecular formula C17H23N4O9P and molecular weight 458.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磷酸丝裂霉素
[(4S,6S,7R,8S)-7-methoxy-12-methyl-10,13-dioxo-11-(2-phosphonooxyethylamino)-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
Also Known As: Mitomycin phosphate, (8a-Methoxy-5-methyl-4,7-dioxo-6-{[2-(phosphonooxy)ethyl]amino}-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl)methyl hydrogen carbonimidate, [(1aS,8S,8aR,8bS)-8a-Methoxy-5-methyl-4,7-dioxo-6-{[2-(phosphonooxy)ethyl]amino}-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl hydrogen carbonimidate, [(4S,6S,7R,8S)-7-methoxy-12-methyl-10,13-dioxo-11-(2-phosphonooxyethylamino)-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate, Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 8-(((aminocarbonyl)oxy)methyl)-1,1a,2,8,8a,8b-hexahydro-8a-methoxy-5-methyl-6-((2-(phosphonooxy)ethyl)amino)-, (1aS-(1aalpha,8beta,8aalpha,8balpha))-
| Molecular Formula | C17H23N4O9P |
|---|---|
| Molecular Weight | 458.12 g/mol |
| LogP | -4.3 |
| Topological Polar Surface Area | 200.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 458.12027 |
| Heavy Atoms | 31 |
| Complexity | 973.0 |
Chemical Identifiers
| CAS Number | 124580-38-7 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)OC)N4)NCCOP(=O)(O)O |
| InChIKey | MNOGBRROKHFONU-CJUKMMNNSA-N |
Product Overview
磷酸丝裂霉素 (CAS 124580-38-7), with molecular formula C17H23N4O9P and molecular weight 458.12 g/mol. IUPAC: [(4S,6S,7R,8S)-7-methoxy-12-methyl-10,13-dioxo-11-(2-phosphonooxyethylamino)-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate.
Chemical Property Profile of 磷酸丝裂霉素
Property Insights of 磷酸丝裂霉素
The XLogP value of -4.3 indicates that 磷酸丝裂霉素 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 200.0 Ų indicates high polarity, suggesting 磷酸丝裂霉素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 磷酸丝裂霉素 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 磷酸丝裂霉素?
The CAS number of 磷酸丝裂霉素 is 124580-38-7.
What is the molecular formula of 磷酸丝裂霉素?
The molecular formula of 磷酸丝裂霉素 is C17H23N4O9P.
What is the molecular weight of 磷酸丝裂霉素?
The molecular weight of 磷酸丝裂霉素 is 458.12 g/mol.
Where can I buy 磷酸丝裂霉素?
You can request a quote for 磷酸丝裂霉素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 磷酸丝裂霉素?
Yes, KEHONG BIO provides custom synthesis services for 磷酸丝裂霉素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.