Mitiromycin
TL;DR: Mitiromycin (CAS 32812-45-6) is a chemical compound with molecular formula C16H17N3O5 and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S,4S,13S)-10-methoxy-3,9-dimethyl-15-oxa-3,6,17-triazapentacyclo[11.4.0.01,6.02,4.07,12]heptadeca-7(12),9-diene-8,11,16-trione
Also Known As: Mitiromycin, Mitiromycin A2, KST-1A3836, (4as,10as,11as,11bs)-6-methoxy-7,11-dimethyl-4,4a,10,10a,11,11a-hexahydroazireno[2',3':3,4]pyrrolo[1,2-a][1,3]oxazino[4,5-b]indole-2,5,8(1h)-trione, (4aS,10aS,11aS,11bR)-2-Hydroxy-6-methoxy-7,11-dimethyl-4,4a,10,10a,11,11a-hexahydroazirino[2',3':3,4]pyrrolo[1,2-a][1,3]oxazino[4,5-b]indole-5,8-dione
| Molecular Formula | C16H17N3O5 |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 88.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 331.11682 |
| Heavy Atoms | 24 |
| Complexity | 800.0 |
Chemical Identifiers
| CAS Number | 32812-45-6 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@]35[C@H]2COC(=O)N5)N4C)OC |
| InChIKey | XIEWXZTXSYSEPW-QXXTYPIOSA-N |
Product Overview
Mitiromycin (CAS 32812-45-6), with molecular formula C16H17N3O5 and molecular weight 331.12 g/mol. IUPAC: (1S,2S,4S,13S)-10-methoxy-3,9-dimethyl-15-oxa-3,6,17-triazapentacyclo[11.4.0.01,6.02,4.07,12]heptadeca-7(12),9-diene-8,11,16-trione.
Chemical Property Profile of Mitiromycin
Property Insights of Mitiromycin
The XLogP value of -0.1 indicates that Mitiromycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mitiromycin. Following Lipinski's Rule of Five, Mitiromycin has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mitiromycin?
The CAS number of Mitiromycin is 32812-45-6.
What is the molecular formula of Mitiromycin?
The molecular formula of Mitiromycin is C16H17N3O5.
What is the molecular weight of Mitiromycin?
The molecular weight of Mitiromycin is 331.12 g/mol.
Where can I buy Mitiromycin?
You can request a quote for Mitiromycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mitiromycin?
Yes, KEHONG BIO provides custom synthesis services for Mitiromycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.