Cas no 34291-02-6 (D-Streptamine,O-2,6-diamino-2,6-dideoxy-a-D-glucopyranosyl-(1®4)-O-[b-D-xylofuranosyl-(1®5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy-)
34291-02-6 structure
Product Name:D-Streptamine,O-2,6-diamino-2,6-dideoxy-a-D-glucopyranosyl-(1®4)-O-[b-D-xylofuranosyl-(1®5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy-
CAS No:34291-02-6
MF:C21H41N5O12
MW:555.576546430588
CID:307016
PubChem ID:12302171
Update Time:2025-04-19
D-Streptamine,O-2,6-diamino-2,6-dideoxy-a-D-glucopyranosyl-(1®4)-O-[b-D-xylofuranosyl-(1®5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy- Chemical and Physical Properties
Names and Identifiers
-
- (2S)-4-Amino-N-[(1R,2S,3R,4R,5S)-5-amino-4-[(2,6-diamino-2,6-dide oxy-α-D-glucopyranosyl)oxy]-2-hydroxy-3-(β-D-xylofuranosyloxy)cyc lohexyl]-2-hydroxybutanamide
- Butirosin A
- 3-BUTENYLMETHYLDICHLOROSILANE
- 5)]-N1-[(2S)-4-amino-2-hydro
- 5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy-
- AG-E-09240
- butenylmethyldichlorosilane
- Butirosin B
- CTK4D0226
- Silane,3-buten-1-yldichloromethyl-
- Silane,3-butenyldichloromethyl- (8CI,9CI)
- CHEBI:65112
- (2S)-4-amino-N-[(1R,2S,3R,4R,5S)-5-amino-4-[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-3-[(2S,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide
- D-Streptamine, O-2,6-diamino-2,6-dideoxy-alpha-D-glucopyranosyl-(1-4)-O-(beta-D-xylofuranosyl-(1-5))-N(sup 1)-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-
- UNII-285798GUS5
- SCHEMBL456140
- (S)-4-amino-N-((1R,2S,3R,4R,5S)-5-amino-4-((2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxytetrahydro-2H-pyran-2-yloxy)-3-((2S,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yloxy)-2-hydroxycyclohexyl)-2-hydroxybutanamide
- D-STREPTAMINE, O-2,6-DIAMINO-2,6-DIDEOXY-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-(.BETA.-D-XYLOFURANOSYL-(1->5))-N1-((2S)-4-AMINO-2-HYDROXY-1-OXOBUTYL)-2-DEOXY-
- 34291-02-6
- (2s)-4-Amino-N-[(1r,2s,3r,4r,5s)-5-Amino-4-[(2,6-Diamino-2,6-Dideoxy-Alpha-D-Glucopyranosyl)oxy]-2-Hydroxy-3-(Beta-D-Xylofuranosyloxy)cyclohexyl]-2-Hydroxybutanamide
- C17585
- NS00011547
- Ambutyrosin A
- Q27133659
- BUTIROSIN A [MI]
- B31
- XEQLFNPSYWZPOW-SVRMBHBBSA-N
- CHEMBL428032
- Ambuyrosin A
- DTXSID801336430
- 285798GUS5
- Butyrosin A
- 4-amino-n-{5-amino-4-[(2,6-diamino-2,6-dideoxyhexopyranosyl)oxy]-2-hydroxy-3-(pentofuranosyloxy)cyclohexyl}-2-hydroxybutanamide
- Butirosin
- FT-0770477
- DTXSID40860625
- SCHEMBL19944113
- D-Streptamine,O-2,6-diamino-2,6-dideoxy-a-D-glucopyranosyl-(1®4)-O-[b-D-xylofuranosyl-(1®5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy-
-
- Inchi: 1S/C21H41N5O12/c22-2-1-8(28)19(34)26-7-3-6(24)17(37-20-11(25)15(32)13(30)9(4-23)35-20)18(12(7)29)38-21-16(33)14(31)10(5-27)36-21/h6-18,20-21,27-33H,1-5,22-25H2,(H,26,34)/t6-,7+,8-,9+,10+,11+,12-,13+,14-,15+,16+,17+,18+,20+,21-/m0/s1
- InChI Key: XEQLFNPSYWZPOW-SVRMBHBBSA-N
- SMILES: O([C@@H]1[C@@H]([C@H]([C@@H]([C@@H](CN)O1)O)O)N)[C@@H]1[C@H](C[C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H](CO)O1)O)O)O)NC([C@H](CCN)O)=O)N
Computed Properties
- Exact Mass: 555.27517176g/mol
- Monoisotopic Mass: 555.27517176g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 12
- Hydrogen Bond Acceptor Count: 16
- Heavy Atom Count: 38
- Rotatable Bond Count: 10
- Complexity: 772
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 15
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 2
- XLogP3: -7.3
- Topological Polar Surface Area: 312
Experimental Properties
- Color/Form: solid
- Density: 1.3764 (rough estimate)
- Boiling Point: 624.91°C (rough estimate)
- Refractive Index: 1.7500 (estimate)
- Solubility: Not determined
- pka: pKa (water): 5.6, 7.3, 8.7, 9.8(at 25℃)
- Specific Rotation: D25 +26° (c = 1.46 in water)
D-Streptamine,O-2,6-diamino-2,6-dideoxy-a-D-glucopyranosyl-(1®4)-O-[b-D-xylofuranosyl-(1®5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy- Security Information
- WGK Germany:3
- Hazard Category Code: 61-20/21/22
- Safety Instruction: 53-22-36/37/39-45
- RTECS:WK2302000
-
Hazardous Material Identification:
- Risk Phrases:R61
D-Streptamine,O-2,6-diamino-2,6-dideoxy-a-D-glucopyranosyl-(1®4)-O-[b-D-xylofuranosyl-(1®5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy- Related Literature
-
Nicholas M. Llewellyn,Jonathan B. Spencer Nat. Prod. Rep. 2006 23 864
-
Patricia M. Flatt,Taifo Mahmud Nat. Prod. Rep. 2007 24 358
-
Sherif I. Elshahawi,Khaled A. Shaaban,Madan K. Kharel,Jon S. Thorson Chem. Soc. Rev. 2015 44 7591
-
Nishad Thamban Chandrika,Sylvie Garneau-Tsodikova Chem. Soc. Rev. 2018 47 1189
-
5. Drug-target networks in aminoglycoside resistance: hierarchy of priority in structural drug designValjean R. Bacot-Davis,Angelia V. Bassenden,Albert M. Berghuis Med. Chem. Commun. 2016 7 103
34291-02-6 (D-Streptamine,O-2,6-diamino-2,6-dideoxy-a-D-glucopyranosyl-(1®4)-O-[b-D-xylofuranosyl-(1®5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy-) Related Products
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