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Basifungin

Basifungin structure

CAS No:
127785-64-2
Formula:
C60H92N8O11
Chemical Name:
Basifungin
Synonyms:
Basifungin;aureobasidin A;Cyclo[L-Phe-N-methyl-L-Phe-L-Pro-L-aIle-N-methyl-L-Val-L-Leu-N-methyl-β-hydroxy-L-Val-[(3R)-D-Hmp-]-N-methyl-L-Val-];LY-295337;Aureobasidin A (9CI);Aureobasidin A (AbA)
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

ChEBI: A cyclodepsipeptide antibiotic, which is isolated from the filamentous fungus Aureobasidium pullulans R106 and is toxic to yeast at low concentrations (0.1-0.5 ug/ml).

Basifungin Basic Attributes

Molecular Weight：

1101.43

Exact Mass：

1100.69000

Characteristics

PSA：

245.85000

XLogP3：

4.88900

Density：

1.19g/cm3

Boiling Point：

1229.1ºC at 760 mmHg

Flash Point：

697.1ºC

Refractive Index：

1.574

Drug Information

MeSH：

Substances that destroy fungi by suppressing their ability to grow or reproduce. They differ from FUNGICIDES, INDUSTRIAL because they defend against fungi present in human or animal tissues. (See all compounds classified as Antifungal Agents.)|Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)

MeSH Entry Terms：

aureobasidin A

Basifungin Use and Manufacturing

Antifungal.Aureobasidin A is a cyclic depsipeptide that is produced byfermentation in cultures of Aureobasidium pullulan.Aureobasidin A acts as a tight-binding noncompetitive inhibitorof the enzyme inositol phosphorylceramide synthase(IPC synthase), which is an essential enzyme for fungalsphingolipid biosynthesis. A unique structural feature of theaureobasidins is the N-methylation of four of seven amide nitrogenatoms. The lack of tautomerism dictated by N-methylationmay contribute to forming a

Computed Properties

Molecular Weight:1101.4
XLogP3:8.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:13
Exact Mass:1100.68855578
Monoisotopic Mass:1100.68855578
Topological Polar Surface Area:235
Heavy Atom Count:79
Complexity:2110
Defined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Basifungin.

CAS No.: 127785-64-2

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CAS No.: 127785-64-2

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