Leucomycin a5

CAT: 0013-GTR19193875-02Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19193875-02Size:5 mg

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Description

Leucomycin A5, a component of the leucomycin complex isolated from Streptomyces kitasatoensis, exhibits antibacterial activity against various Gram-positive and some Gram-negative bacteria. It is useful for in vitro microbiological research, particularly in studies involving penicillin-resistant Streptococcus pyogenes and Enterococcus faecalis, with typical MIC values ranging from 0.04 to 3.2 μg/ml.

CAS Number

18361-45-0

Field of Research

Infectious Disease & Virology

Smiles

[H][C@@]1 (C[C@@] (C) (O) [C@@H] (OC (=O) CCC) [C@H] (C) O1) O[C@@H]1[C@@H] (C) O[C@@] ([H]) (O[C@H]2[C@@H] (CC=O) C[C@@H] (C) [C@@H] (O) \C=C\C=C\C[C@@H] (C) OC (=O) C[C@@H] (O) [C@@H]2OC) [C@H] (O) [C@H]1N (C) C

Molecular Formula

C39H65NO14

Molecular Weight

771.93

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Leucomycin A5

Leucomycin A5 is a macrolide and a butyrate ester.

CAS Number	18361-45-0
PubChem CID	5282324
IUPAC Name	[(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] butanoate
Molecular Formula	C39H65NO14
Molecular Weight	771.9
XLogP	1.9
Topological Polar Surface Area	200
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	12
Heavy Atom Count	54
Formal Charge	0
Complexity	1250

SMILES

CCCC(=O)O[C@H]1[C@@H](O[C@H](C[C@@]1(C)O)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2N(C)C)O)O[C@H]3[C@H](C[C@H]([C@H](/C=C/C=C/C[C@H](OC(=O)C[C@H]([C@@H]3OC)O)C)O)C)CC=O)C)C

InChI

InChI=1S/C39H65NO14/c1-10-14-29(44)52-37-25(5)50-31(21-39(37,6)47)53-34-24(4)51-38(33(46)32(34)40(7)8)54-35-26(17-18-41)19-22(2)27(42)16-13-11-12-15-23(3)49-30(45)20-28(43)36(35)48-9/h11-13,16,18,22-28,31-38,42-43,46-47H,10,14-15,17,19-21H2,1-9H3/b12-11+,16-13+/t22-,23-,24-,25+,26+,27+,28-,31+,32-,33-,34-,35+,36+,37+,38+,39-/m1/s1

InChIKey

JZVYPSLDMXOITF-MJRCUCNNSA-N

Chemical Structure

2D Structure

CAS: 18361-45-0

CID: 5282324

Formula: C39H65NO14

MW: 771.9

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	771.9
XLogP3	1.9
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	12
Exact Mass	771.44050575
Monoisotopic Mass	771.44050575
Topological Polar Surface Area	200 Å²
Heavy Atom Count	54
Formal Charge	0
Complexity	1250
Isotope Atom Count	0
Defined Atom Stereocenter Count	16
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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561573	Leucomycin
AL24876-01	Leucomycin A3
T38290	Leucomycin A4
TN10662-01	Leucomycin A7
453650-01	Leucomycin A13
L031-1MG	Leucomycin A1
TRC-L330328-500MG	Leucomycin Tartrate
sc-362763	Leucomycin A5
HY-N15421	Leucomycin A8
HY-N15086	Leucomycin U

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