Martinomycin
TL;DR: Martinomycin (CAS 160791-16-2) is a chemical compound with molecular formula C49H84O17 and molecular weight 944.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[(2S,3S,4S,5S,6S)-2-hydroxy-6-[[(2R,3R,4R,5S,6R,7R,9S)-2-[(2R,5S)-5-[(2R,5R)-5-[(2S,3S,4S,5R,6S)-6-hydroxy-4-[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]oxolan-2-yl]-3,7-dimethoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4,5-dimethoxy-3,5-dimethyloxan-2-yl]propanoic acid
Also Known As: Martinomycin, LL-D 37187alpha;Martinomycin, LL-D 37187alpha, Martinomycin, 2-Deoxy-2-methylantibiotic K-41, (2R)-2-[(2S,3S,4S,5S,6S)-2-hydroxy-6-[[(2R,3R,4R,5S,6R,7R,9S)-2-[(2R,5S)-5-[(2R,5R)-5-[(2S,3S,4S,5R,6S)-6-hydroxy-4-[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]oxolan-2-yl]-3,7-dimethoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4,5-dimethoxy-3,5-dimethyloxan-2-yl]propanoic acid
| Molecular Formula | C49H84O17 |
|---|---|
| Molecular Weight | 944.57 g/mol |
| LogP | 5.217 |
| Topological Polar Surface Area | 197.75 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 14 |
| Exact Mass | 944.57086 |
| Heavy Atoms | 66 |
| Complexity | 1653.9877 |
Chemical Identifiers
| CAS Number | 160791-16-2 |
|---|---|
| SMILES | C[C@@H]1[C@H](O[C@]([C@@H]([C@H]1O[C@H]2CC[C@@H]([C@H](O2)C)OC)C)(C)O)[C@H]3CC[C@@H](O3)[C@@H]4CC[C@@H](O4)[C@@]5([C@@H]([C@H]([C@@]6(O5)[C@@H]([C@@H](C[C@H](O6)C[C@H]7[C@]([C@H]([C@@H]([C@](O7)([C@@H](C)C(=O)O)O)C)OC)(C)OC)OC)C)C)OC)C |
Product Overview
Martinomycin (CAS 160791-16-2), with molecular formula C49H84O17 and molecular weight 944.57 g/mol. IUPAC: (2R)-2-[(2S,3S,4S,5S,6S)-2-hydroxy-6-[[(2R,3R,4R,5S,6R,7R,9S)-2-[(2R,5S)-5-[(2R,5R)-5-[(2S,3S,4S,5R,6S)-6-hydroxy-4-[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]oxolan-2-yl]-3,7-dimethoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4,5-dimethoxy-3,5-dimethyloxan-2-yl]propanoic acid.
Chemical Property Profile of Martinomycin
Property Insights of Martinomycin
The XLogP value of 5.217 indicates that Martinomycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 197.75 Ų indicates high polarity, suggesting Martinomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Martinomycin has 3 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Martinomycin?
The CAS number of Martinomycin is 160791-16-2.
What is the molecular formula of Martinomycin?
The molecular formula of Martinomycin is C49H84O17.
What is the molecular weight of Martinomycin?
The molecular weight of Martinomycin is 944.57 g/mol.
Where can I buy Martinomycin?
You can request a quote for Martinomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Martinomycin?
Yes, KEHONG BIO provides custom synthesis services for Martinomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.