CS-1000113
(2S,3S,4R)-2-Amino-3-hydroxy-4-[(1-oxohexacosyl)oxy]octadecyl α-D-galactopyranoside
Manufacturer: ChemScene
CAS Number: 1541195-53-2
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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
C₅₀H₉₉NO₉
Molecular Weight
858.32
Synonyms
None
SMILES
O(C[C@@H]([C@@H]([C@H](OC(CCCCCCCCCCCCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCCC)O)N)[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Tpsa
171.93
Logp
10.8764
H Acceptors
10
H Donors
6
Rotatable Bonds
44
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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: C₅₀H₉₉NO₉
Molecular Weight: 858.32
Synonyms: None
SMILES: O(C[C@@H]([C@@H]([C@H](OC(CCCCCCCCCCCCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCCC)O)N)[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Tpsa: 171.93
Logp: 10.8764
H Acceptors: 10
H Donors: 6
Rotatable Bonds: 44
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₀H₉₉NO₉
Molecular Weight:
858.32
Synonyms:
None
SMILES:
O(C[C@@H]([C@@H]([C@H](OC(CCCCCCCCCCCCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCCC)O)N)[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Tpsa:
171.93
Logp:
10.8764
H Acceptors:
10
H Donors:
6
Rotatable Bonds:
44
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₈H₃₈N₄O₇
Molecular Weight: 662.73
Synonyms: None
SMILES: C(OC[C@H]1O[C@H](C[C@@H]1O)N2C3=C(C(C#C)=C2)C(=O)N=C(NC(C(C)C)=O)N3)(C4=CC=C(OC)C=C4)(C5=CC=C(OC)C=C5)C6=CC=CC=C6
Tpsa: 136.93
Logp: 4.9747
H Acceptors: 9
H Donors: 3
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₃₈N₄O₇
Molecular Weight:
662.73
Synonyms:
None
SMILES:
C(OC[C@H]1O[C@H](C[C@@H]1O)N2C3=C(C(C#C)=C2)C(=O)N=C(NC(C(C)C)=O)N3)(C4=CC=C(OC)C=C4)(C5=CC=C(OC)C=C5)C6=CC=CC=C6
Tpsa:
136.93
Logp:
4.9747
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₀N₄O₅
Molecular Weight: 360.36
Synonyms: None
SMILES: C(#C)C=1C2=C(N(C1)[C@@H]3O[C@H](CO)[C@@H](O)C3)NC(NC(C(C)C)=O)=NC2=O
Tpsa: 129.47
Logp: -0.0589
H Acceptors: 7
H Donors: 4
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₀N₄O₅
Molecular Weight:
360.36
Synonyms:
None
SMILES:
C(#C)C=1C2=C(N(C1)[C@@H]3O[C@H](CO)[C@@H](O)C3)NC(NC(C(C)C)=O)=NC2=O
Tpsa:
129.47
Logp:
-0.0589
H Acceptors:
7
H Donors:
4
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₄N₄O₄
Molecular Weight: 290.27
Synonyms: None
SMILES: C(#C)C=1C2=C(N(C1)[C@@H]3O[C@H](CO)[C@@H](O)C3)NC(N)=NC2=O
Tpsa: 126.39
Logp: -1.0712
H Acceptors: 7
H Donors: 4
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₄N₄O₄
Molecular Weight:
290.27
Synonyms:
None
SMILES:
C(#C)C=1C2=C(N(C1)[C@@H]3O[C@H](CO)[C@@H](O)C3)NC(N)=NC2=O
Tpsa:
126.39
Logp:
-1.0712
H Acceptors:
7
H Donors:
4
Rotatable Bonds:
2