CS-0535699
N-((2S,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)pent-4-ynamide
Manufacturer: ChemScene
CAS Number: 935658-94-9
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₁₇NO₆
Molecular Weight
259.26
Synonyms
2-deoxy-2-[(1-oxo-4-pentyn-1-yl)amino]-D-Mannsopyranose
SMILES
[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)(NC(CCC#C)=O)C=O
Tpsa
127.09
Logp
-2.8415
H Acceptors
6
H Donors
5
Rotatable Bonds
8
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₇NO₆
Molecular Weight: 259.26
Synonyms: 2-deoxy-2-[(1-oxo-4-pentyn-1-yl)amino]-D-Mannsopyranose
SMILES: [C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)(NC(CCC#C)=O)C=O
Tpsa: 127.09
Logp: -2.8415
H Acceptors: 6
H Donors: 5
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₇NO₆
Molecular Weight:
259.26
Synonyms:
2-deoxy-2-[(1-oxo-4-pentyn-1-yl)amino]-D-Mannsopyranose
SMILES:
[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)(NC(CCC#C)=O)C=O
Tpsa:
127.09
Logp:
-2.8415
H Acceptors:
6
H Donors:
5
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₀O₇
Molecular Weight: 276.28
Synonyms: (3Ar,5R,6aS)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxole-6,6-diol
SMILES: CC1(OC[C@H](O1)[C@@H]2C([C@@H]3[C@H](O2)OC(O3)(C)C)(O)O)C
Tpsa: 86.61
Logp: -0.3048
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₀O₇
Molecular Weight:
276.28
Synonyms:
(3Ar,5R,6aS)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxole-6,6-diol
SMILES:
CC1(OC[C@H](O1)[C@@H]2C([C@@H]3[C@H](O2)OC(O3)(C)C)(O)O)C
Tpsa:
86.61
Logp:
-0.3048
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₄O₆
Molecular Weight: 194.18
Synonyms: 3-O-Methyl-d-glucose
SMILES: [C@H]([C@@H]([C@@H](CO)O)O)([C@H](C=O)O)OC
Tpsa: 107.22
Logp: -2.7247
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₄O₆
Molecular Weight:
194.18
Synonyms:
3-O-Methyl-d-glucose
SMILES:
[C@H]([C@@H]([C@@H](CO)O)O)([C@H](C=O)O)OC
Tpsa:
107.22
Logp:
-2.7247
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₂₂O₈
Molecular Weight: 474.46
Synonyms: β-D-Glucopyranose, 1,6-anhydro-, 2,3,4-tribenzoate
SMILES: O(C(=O)C1=CC=CC=C1)[C@H]2[C@H](OC(=O)C3=CC=CC=C3)[C@@H]4O[C@H]([C@@H]2OC(=O)C5=CC=CC=C5)OC4
Tpsa: 97.36
Logp: 3.4183
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₂₂O₈
Molecular Weight:
474.46
Synonyms:
β-D-Glucopyranose, 1,6-anhydro-, 2,3,4-tribenzoate
SMILES:
O(C(=O)C1=CC=CC=C1)[C@H]2[C@H](OC(=O)C3=CC=CC=C3)[C@@H]4O[C@H]([C@@H]2OC(=O)C5=CC=CC=C5)OC4
Tpsa:
97.36
Logp:
3.4183
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
6