Micafungin (DISCONTINUED)

Basic Information

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CAS Number

235114-32-6

Molecular Formula

C56H71N9O23S

Molecular Weight

1270.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

°Cat760mmHg

Density

1.62

Refractive Index

1.706

SMILES

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CCCCCOC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(C=C3)C(=O)NC4CC(C(NC(=O)C5C(C(CN5C(=O)C(NC(=O)C(NC(=O)C6CC(CN6C(=O)C(NC4=O)C(C)O)O)C(C(C7=CC(=C(C=C7)O)OS(=O)(=O)O)O)O)C(CC(=O)N)O)C)O)O)O

InChI

InChI=1S/C56H71N9O23S/c1-4-5-6-17-86-32-14-11-28(12-15-32)39-21-33(63-87-39)27-7-9-29(10-8-27)49(75)58-34-20-38(70)52(78)62-54(80)45-46(72)25(2)23-65(45)56(82)43(37(69)22-41(57)71)60-53(79)44(48(74)47(73)30-13-16-36(68)40(18-30)88-89(83,84)85)61-51(77)35-19-31(67)24-64(35)55(81)42(26(3)66)59-50(34)76/h7-16,18,21,25-26,31,34-35,37-38,42-48,52,66-70,72-74,78H,4-6,17,19-20,22-24H2,1-3H3,(H2,57,71)(H,58,75)(H,59,76)(H,60,79)(H,61,77)(H,62,80)(H,83,84,85)/t25-,26+,31+,34-,35-,37+,38+,42-,43-,44-,45-,46-,47-,48-,52+/m0/s1

InChIKey

PIEUQSKUWLMALL-YABMTYFHSA-N

LogP

-3.9019999999999966

Topological Polar Surface Area

510.14000000000004 Å²

Hydrogen Bond Donor/Acceptor

17 / 32

Complexity

2580

Synonyms & References

English

Micafungin [INN]
PNEUMOCANDIN A0, 1-((4R,5R)-4,5-DIHYDROXY-N(SUP 2)-(4-(5-(4-(PENTYLOXY)PHENYL)-3-ISOXAZOLYL)BENZOYL)-L-ORNITHINE)-4-((4S)-4-HYDROXY-4-(4-HYDROXY-3-(SULFOOXY)PHENYL)-L-THREONINE)-
CHEBI:600520
CHEMBL457547
DTXCID20820848
Micafungin
PIEUQSKUWLMALL-YABMTYFHSA-N
EN300-19634541
Pneumocandin A0, 1-((4R,5R)-4,5-dihydroxy-N2-(4-(5-(4-(pentyloxy)phenyl)-3-isoxazolyl)benzoyl)-L-ornithine)-4-((4S)-4-hydroxy-4-(4-hydroxy-3-(sulfooxy)phenyl)-L-threonine)-
BDBM50478216
DTXSID90873341
UNII-R10H71BSWG
[5-[(1S,2S)-2-[[(1R)-3-amino-1-hydroxy-3-oxo-propyl]-tetrahydroxy-[(1R)-1-hydroxyethyl]-methyl-hexaoxo-[[4-[5-(4-pentoxyphenyl)isoxazol-3-yl]benzoyl]amino][?]yl]-1,2-dihydroxy-ethyl]-2-hydroxy-phenyl] hydrogen sulfate
5.1:6-anhydro{(4R,5R)-4,5-dihydroxy-N(2)-(4-{5-[4-(pentyloxy)phenyl]isoxazol-3-yl}benzoyl)-L-ornithyl-L-threonyl-(4R)-4-hydroxy-L-prolyl-(4S)-4-hydroxy-4-[4-hydroxy-3-(sulfooxy)phenyl]-L-threonyl-(3R)-3-hydroxy-L-glutaminyl-(3S,4S)-3-hydroxy-4-methyl-L-proline}
235114-32-6
SCHEMBL11893279
Mycamine(TM)
Mycamine
MICAFUNGIN [VANDF]
D08218
MICAFUNGIN [JAN]
micafungine
MICAFUNGIN [EMA EPAR]
Micafungin(free acid)?
Micafungina
micafunginum
DB01141
R10H71BSWG
Micafungin (INN)
MICAFUNGIN [MI]
J-015136

MDL Number

MFCD09837852

FAQ

What are the physical and chemical properties of Micafungin (CAS: 235114-32-6)?

Micafungin is a polyene antifungal agent with a molecular weight of approximately 543.68 g/mol. It has a crystalline form with a melting point of about 260-264°C. Micafungin is poorly soluble in water but soluble in most organic solvents. Chemically, it is known for its stability and low reactivity under normal conditions, with no significant chemical reactions observed under typical storage conditions.

How is Micafungin (CAS: 235114-32-6) typically synthesized?

Micafungin is typically synthesized through a complex multistep process involving fermentation, chemical modification, and purification. The process requires specific catalysts and reagents, with high selectivity and yield, making it suitable for large-scale production in pharmaceutical industries.

What industries use Micafungin (CAS: 235114-32-6)?

Micafungin is used primarily in the pharmaceutical industry for the treatment of fungal infections. It has applications in the healthcare sector, specifically in hospitals and clinics, where it is administered intravenously or intramuscularly. While not directly used in industries like polymers or semiconductors, its production and distribution can impact these sectors indirectly.

What precautions should be taken when handling Micafungin (CAS: 235114-32-6)?

When handling Micafungin, proper personal protective equipment (PPE) such as gloves, lab coats, and safety glasses should be worn to avoid skin and eye contact. Work should be conducted in a well-ventilated area or a fume hood to prevent inhalation. Spills should be cleaned up immediately using appropriate methods, and the Material Safety Data Sheet (MSDS) should be consulted for specific handling and disposal instructions.