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midecamycin acetate structure
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midecamycin acetate

TL;DR: midecamycin acetate (CAS 55881-07-7) is a chemical compound with molecular formula C45H71NO17 and molecular weight 897.4722 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[(4R,5S,6S,7R,9R,10R,16R)-10-acetyloxy-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-4-acetyloxy-4,6-dimethyl-5-propanoyloxyoxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] propanoate

Also Known As: midecamycin acetate, 5,6-BIS[(4-FLUOROPHENYL)AMINO]-1H-ISOINDOLE-1,3(2H)-DIONE

CAS Number
55881-07-7
Molecular Formula
C45H71NO17
Molecular Weight
897.4722 g/mol
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Technical Specifications

Molecular FormulaC45H71NO17
Molecular Weight897.4722 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)218.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors18
Rotatable Bonds18
Exact Mass897.4722 Da
Heavy Atoms63
Complexity1590.0
SMILESCCC(=O)O[C@@H]1CC(=O)O[C@@H](CC=CC=C[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]1OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)CC)(C)OC(=O)C)N(C)C)O)CC=O)C)OC(=O)C)C
InChIKeyGQNZGCARKRHPOH-UEZYHSOPSA-N

Chemical Property Profile of midecamycin acetate

XLogP
3.8
TPSA (Topological Polar Surface Area)
218.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
18
Rotatable Bonds
18
Heavy Atoms
63
Complexity
1590.0
Exact Mass
897.4722
Monoisotopic Mass
897.4722
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of midecamycin acetate

The XLogP value of 3.8 indicates that midecamycin acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 218.0 Ų indicates high polarity, suggesting midecamycin acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, midecamycin acetate has 1 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of midecamycin acetate?

The CAS number of midecamycin acetate is 55881-07-7.

What is the molecular formula of midecamycin acetate?

The molecular formula of midecamycin acetate is C45H71NO17.

What is the molecular weight of midecamycin acetate?

The molecular weight of midecamycin acetate is 897.4722 g/mol.

Where can I buy midecamycin acetate?

You can request a quote for midecamycin acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for midecamycin acetate?

Yes, CoreyChem provides custom synthesis services for midecamycin acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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