Molecule

rhodostreptomycin a

AlkaPlorer ID: AK058390

Synonym: None

IUPAC Name: 2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[[(4S,5R,6R,8R,9R)-9-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-6-methyl-2-oxo-1,7-dioxa-3-azaspiro[4.4]nonan-8-yl]oxy]-2,5,6-trihydroxycyclohexyl]guanidine

Structure

SMILES: CN[C@@H]1[C@H](O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](NC(=N)N)[C@@H](O)[C@@H]3NC(=N)N)O[C@H](C)[C@@]23OC(O)=N[C@H]3O)O[C@@H](CO)[C@H](O)[C@H]1O

InChI: InChI=1S/C22H40N8O13/c1-4-22(18(37)30-21(38)43-22)15(42-16-8(27-2)12(35)9(32)5(3-31)40-16)17(39-4)41-14-7(29-20(25)26)10(33)6(28-19(23)24)11(34)13(14)36/h4-18,27,31-37H,3H2,1-2H3,(H,30,38)(H4,23,24,28)(H4,25,26,29)/t4-,5+,6-,7+,8+,9+,10-,11+,12+,13-,14-,15+,16+,17+,18+,22-/m1/s1

InChIKey: DGVZNVLARKDWED-PUVNOVANSA-N

Reference

Rhodostreptomycins, Antibiotics Biosynthesized Following Horizontal Gene Transfer from <i>Streptomyces padanus</i> to <i>Rhodococcus fascians</i>

PubChem CID: 139586164

LOTUS: LTS0057462

NPASS: NPC490579

{

NPAtlas: NPA011063

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Rhodococcus fascians	Rhodococcus	Nocardiaceae	Mycobacteriales	Actinomycetes	Actinomycetota	None	Bacteria

Properties Information

Molecule Weight: 624.6050000000004

TPSA？: 356.18000000000006

MolLogP？: -7.670360000000007

Number of H-Donors: 15

Number of H-Acceptors: 16

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi