CS-0466814
(4R)-4-((3S,5S,7R,8R,9S,10R,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-1-((6aR,6bR,8aR,11R,12S,12aS,12bR,14bS)-4,4,6a,6b,8a,11,12,14b-octamethyldocosahydropicen-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
Manufacturer: ChemScene
CAS Number: 88426-32-8
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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
C₅₄H₉₀O₅
Molecular Weight
819.29
Synonyms
Ursulcholic acid
SMILES
C[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CCC(C6C[C@H](C[C@H]7C[C@H]([C@H]8[C@@H]9CC[C@H]([C@H](C)CCC(=O)O)[C@@]9(C)[C@H](C[C@@H]8[C@]76C)O)O)O)C(C)(C)C5CC[C@]43C)[C@@H]2[C@H]1C
Tpsa
97.99
Logp
12.0484
H Acceptors
4
H Donors
4
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 88426-32-8 | Ursulcholic | A2B Chem | -- |
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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: C₅₄H₉₀O₅
Molecular Weight: 819.29
Synonyms: Ursulcholic acid
SMILES: C[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CCC(C6C[C@H](C[C@H]7C[C@H]([C@H]8[C@@H]9CC[C@H]([C@H](C)CCC(=O)O)[C@@]9(C)[C@H](C[C@@H]8[C@]76C)O)O)O)C(C)(C)C5CC[C@]43C)[C@@H]2[C@H]1C
Tpsa: 97.99
Logp: 12.0484
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₄H₉₀O₅
Molecular Weight:
819.29
Synonyms:
Ursulcholic acid
SMILES:
C[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CCC(C6C[C@H](C[C@H]7C[C@H]([C@H]8[C@@H]9CC[C@H]([C@H](C)CCC(=O)O)[C@@]9(C)[C@H](C[C@@H]8[C@]76C)O)O)O)C(C)(C)C5CC[C@]43C)[C@@H]2[C@H]1C
Tpsa:
97.99
Logp:
12.0484
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
5
Purity: 98%
MDL No: MFCD03095307
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₄ClFIN
Molecular Weight: 271.46
Synonyms: 2-CHLORO-5-FLUORO-4-IODO-3-PICOLINE
SMILES: CC1=C(C(=CN=C1Cl)F)I
Tpsa: 12.89
Logp: 2.78712
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD03095307
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₄ClFIN
Molecular Weight:
271.46
Synonyms:
2-CHLORO-5-FLUORO-4-IODO-3-PICOLINE
SMILES:
CC1=C(C(=CN=C1Cl)F)I
Tpsa:
12.89
Logp:
2.78712
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₂BrFN₂O₃
Molecular Weight: 236.98
Synonyms: 4-Bromo-5-fluoro-2-hydroxy-3-nitropyridine
SMILES: C1=C(C(=C(C(=N1)O)[N+](=O)[O-])Br)F
Tpsa: 76.26
Logp: 1.597
H Acceptors: 4
H Donors: 1
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:
C₅H₂BrFN₂O₃
Molecular Weight:
236.98
Synonyms:
4-Bromo-5-fluoro-2-hydroxy-3-nitropyridine
SMILES:
C1=C(C(=C(C(=N1)O)[N+](=O)[O-])Br)F
Tpsa:
76.26
Logp:
1.597
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD03419845
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀O₂S
Molecular Weight: 170.23
Synonyms: 4-ethyl-5-methyl-3-thiophenecarboxylic acid
SMILES: CCC1=C(C)SC=C1C(=O)O
Tpsa: 37.3
Logp: 2.31712
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD03419845
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀O₂S
Molecular Weight:
170.23
Synonyms:
4-ethyl-5-methyl-3-thiophenecarboxylic acid
SMILES:
CCC1=C(C)SC=C1C(=O)O
Tpsa:
37.3
Logp:
2.31712
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2