CS-0533288
(4S,4aS,5aS,6S,12aS)-2-Acetyl-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-4a,5,5a,6-tetrahydrotetracene-1,11(4H,12aH)-dione Oxytetracycline Impurity
Manufacturer: ChemScene
CAS Number: 6542-44-5
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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
C₂₃H₂₅NO₈
Molecular Weight
443.45
Synonyms
Adotc cpd
SMILES
O[C@@]12[C@@]([C@@H](C(O)=C(C2=O)C(C)=O)N(C)C)([H])C[C@@]3([H])C(C(C4=C(O)C=CC=C4[C@]3(O)C)=O)=C1O
Tpsa
155.6
Logp
0.8893
H Acceptors
9
H Donors
5
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 6542-44-5 | (4S,4aS,5aS,6S,12aS)-2-Acetyl-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-4a,5,5a,6-tetrahydrotetracene-1,11(4H,12aH)-dione | A2B Chem | -- |
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₂₃H₂₅NO₈
Molecular Weight: 443.45
Synonyms: Adotc cpd
SMILES: O[C@@]12[C@@]([C@@H](C(O)=C(C2=O)C(C)=O)N(C)C)([H])C[C@@]3([H])C(C(C4=C(O)C=CC=C4[C@]3(O)C)=O)=C1O
Tpsa: 155.6
Logp: 0.8893
H Acceptors: 9
H Donors: 5
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:
C₂₃H₂₅NO₈
Molecular Weight:
443.45
Synonyms:
Adotc cpd
SMILES:
O[C@@]12[C@@]([C@@H](C(O)=C(C2=O)C(C)=O)N(C)C)([H])C[C@@]3([H])C(C(C4=C(O)C=CC=C4[C@]3(O)C)=O)=C1O
Tpsa:
155.6
Logp:
0.8893
H Acceptors:
9
H Donors:
5
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: C₁₇H₂₆ClNO₂
Molecular Weight: 311.85
Synonyms: Venlafaxine Related Compound E
SMILES: CN(COC12CCCCC2)CC1C(C=C3)=CC=C3OC.Cl
Tpsa: 21.7
Logp: 3.823
H Acceptors: 3
H Donors: 0
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:
C₁₇H₂₆ClNO₂
Molecular Weight:
311.85
Synonyms:
Venlafaxine Related Compound E
SMILES:
CN(COC12CCCCC2)CC1C(C=C3)=CC=C3OC.Cl
Tpsa:
21.7
Logp:
3.823
H Acceptors:
3
H Donors:
0
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: C₃₄H₄₇NO₇
Molecular Weight: 581.74
Synonyms: 4-O-(2-Hydroxy-2-(4-hydroxy-3-(hydroxymethyl)phenyl)ethyl) salmeterol
SMILES: OC1=CC=C(C(COC2=CC=C(C(CNCCCCCCOCCCCC3=CC=CC=C3)O)C=C2CO)O)C=C1CO
Tpsa: 131.64
Logp: 4.7121
H Acceptors: 8
H Donors: 6
Rotatable Bonds: 21
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₄H₄₇NO₇
Molecular Weight:
581.74
Synonyms:
4-O-(2-Hydroxy-2-(4-hydroxy-3-(hydroxymethyl)phenyl)ethyl) salmeterol
SMILES:
OC1=CC=C(C(COC2=CC=C(C(CNCCCCCCOCCCCC3=CC=CC=C3)O)C=C2CO)O)C=C1CO
Tpsa:
131.64
Logp:
4.7121
H Acceptors:
8
H Donors:
6
Rotatable Bonds:
21
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₃NO₃
Molecular Weight: 255.27
Synonyms: (+/-)-6-Benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
SMILES: O=C(C1C2=CC(C(C3=CC=CC=C3)=O)=CN2CC1)O
Tpsa: 59.3
Logp: 2.291
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₃NO₃
Molecular Weight:
255.27
Synonyms:
(+/-)-6-Benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
SMILES:
O=C(C1C2=CC(C(C3=CC=CC=C3)=O)=CN2CC1)O
Tpsa:
59.3
Logp:
2.291
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3