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Polyoxin B

CAT: 0931-T28436-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T28436-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19396-06-6
Target
Antifungal, Antibiotic
Related Pathways
Microbiology/Virology
Purity
0.7994
Bioactivity
Polyoxin B is an antifungal peptidyl nucleoside antibiotic that inhibits fungal cell wall biosynthesis.
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=C(CO)C(=O)NC2=O
Molecular Formula
C17H25N5O13
Molecular Weight
507.41
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Polyoxin B
CAS Number19396-06-6
PubChem CID181352
IUPAC Name(2S)-2-[[(2S,3S,4S)-2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl]amino]-2-[(2R,3S,4R,5R)-3,4-dihydroxy-5-[5-(hydroxymethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]acetic acid
Molecular FormulaC17H25N5O13
Molecular Weight507.4
XLogP-8.1
Topological Polar Surface Area305
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count14
Rotatable Bond Count11
Heavy Atom Count35
Formal Charge0
Complexity898
SMILES
C1=C(C(=O)NC(=O)N1[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)CO
InChI
InChI=1S/C17H25N5O13/c18-6(8(25)5(24)3-34-16(19)32)13(29)20-7(15(30)31)11-9(26)10(27)14(35-11)22-1-4(2-23)12(28)21-17(22)33/h1,5-11,14,23-27H,2-3,18H2,(H2,19,32)(H,20,29)(H,30,31)(H,21,28,33)/t5-,6-,7-,8+,9-,10+,11+,14+/m0/s1
InChIKey
YFZNSPMAOIVQRP-YVKGXWRCSA-N
Chemical Structure
2D Structure
2D structure of Polyoxin B
CAS: 19396-06-6
CID: 181352
Formula: C17H25N5O13
MW: 507.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data

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