Polyoxin A
AlkaPlorer ID: AK030264
Synonym: '', 'Polyoxin A'
IUPAC Name: (2S,3Z)-1-[(2S)-2-[[(2S,3S,4S)-2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl]amino]-2-[(3S,4R,5R)-3,4-dihydroxy-5-[5-(hydroxymethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]acetyl]-3-ethylideneazetidine-2-carboxylic acid
Structure
SMILES: C/C=C1/CN(C(=O)[C@@H](N=C(O)[C@@H](N)[C@H](O)[C@@H](O)COC(=N)O)C2O[C@@H](N3C=C(CO)C(O)=NC3=O)[C@H](O)[C@@H]2O)[C@@H]1C(=O)O
InChI: InChI=1S/C23H32N6O14/c1-2-7-3-28(12(7)21(38)39)19(37)11(26-18(36)10(24)13(32)9(31)6-42-22(25)40)16-14(33)15(34)20(43-16)29-4-8(5-30)17(35)27-23(29)41/h2,4,9-16,20,30-34H,3,5-6,24H2,1H3,(H2,25,40)(H,26,36)(H,38,39)(H,27,35,41)/b7-2-/t9-,10-,11-,12-,13+,14-,15+,16?,20+/m0/s1
InChIKey: PQAGMWMKVWTHJU-PTHNDGOXSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces cacaoi | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 616.5370000000004
TPSA？: 335.03000000000003
MolLogP？: -4.814329999999989
Number of H-Donors: 11
Number of H-Acceptors: 16
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|