Polyoxin L

CAT: 0013-GTR19255542-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19255542-01Size:10 mg

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Description

Polyoxin L is a nucleoside-type antifungal antibiotic that is notably effective against rice sheath blight.

CAS Number

22976-90-5

Field of Research

Infectious Disease & Virology

Smiles

O[C@H]1[C@@H] (O[C@] ([C@H] (NC ([C@H] ([C@@H] ([C@H] (COC (N) =O) O) O) N) =O) C (O) =O) ([C@H]1O) [H]) N2C (=O) NC (=O) C=C2

Molecular Formula

C16H23N5O12

Molecular Weight

477.38

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

5-((2-Amino-5-O-(aminocarbonyl)-2-deoxy-L-xylonoyl)amino)-1,5-dideoxy-1-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-beta-D-allofuranuronic acid

Polyoxin L is a dipeptide.

CAS Number	22976-90-5
PubChem CID	11762533
IUPAC Name	(2S)-2-[[(2S,3S,4S)-2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl]amino]-2-[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]acetic acid
Molecular Formula	C16H23N5O12
Molecular Weight	477.38
XLogP	-7.7
Topological Polar Surface Area	284
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	10
Heavy Atom Count	33
Formal Charge	0
Complexity	837

SMILES

C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)[C@@H](C(=O)O)NC(=O)[C@H]([C@@H]([C@H](COC(=O)N)O)O)N)O)O

InChI

InChI=1S/C16H23N5O12/c17-6(8(24)4(22)3-32-15(18)30)12(27)20-7(14(28)29)11-9(25)10(26)13(33-11)21-2-1-5(23)19-16(21)31/h1-2,4,6-11,13,22,24-26H,3,17H2,(H2,18,30)(H,20,27)(H,28,29)(H,19,23,31)/t4-,6-,7-,8+,9-,10+,11+,13+/m0/s1

InChIKey

XQOJMTZGJFOLKB-XLUGQHFYSA-N

Chemical Structure

2D Structure

CAS: 22976-90-5

CID: 11762533

Formula: C16H23N5O12

MW: 477.38

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	477.38
XLogP3	-7.7
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	10
Exact Mass	477.13432119
Monoisotopic Mass	477.13432119
Topological Polar Surface Area	284 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	837
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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GTR19255521-01	Polyoxin J
GTR19255396-01	Polyoxin E
GTR19199776-01	Polyoxin C
GTR19266120-01	Polyoxin M
GTR19255313-01	Polyoxin H

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Catalog	Name
TN10246-01	Polyoxin A
HY-N15107	Polyoxin M
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HY-136461	Polyoxin D
TN11033-01	Polyoxin H
T28436-01	Polyoxin B
HY-N14215	Polyoxin K
HY-N14208	Polyoxin E
TN10886-01	Polyoxin F
TN10845-01	Polyoxin J

Polyoxin L

Chemical Information

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