CS-0533006
15,19-Epoxy(5E,9E)-3H-pyrido[2,1-c][1,4]oxaazacyclotricosine-1,7,20,21(4H,23H)-tetrone, 8,11,12,13,14,15,16,17,18,19,24,25,26,26a-tetradecahydro-19-hydroxy-3-[(1E)-2-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]-1-methylethenyl]-14,16-dimethoxy-4,10,12,18-tetramethyl-8-(2-propen-1-yl)-, (3S,4R,8R,12S,14S,15R,16S,18R,19R,26aS)- Tacrolimus Impurity
Manufacturer: ChemScene
CAS Number: 104987-16-8
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Purity
98%
MDL No
None
Storage
4°C, stored under nitrogen
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₄₄H₆₇NO₁₁
Molecular Weight
786.00
Synonyms
delta23-FK-506
SMILES
CO[C@@H]1[C@]2([H])O[C@]([C@@H](C1)C)(C(C(N3[C@](CCCC3)([H])C(O[C@@H]([C@@H](/C=C/C([C@@H](/C=C(C[C@@H](C[C@@H]2OC)C)\C)CC=C)=O)C)/C(C)=C/[C@H]4C[C@H]([C@@H](CC4)O)OC)=O)=O)=O)O
Tpsa
158.13
Logp
5.4442
H Acceptors
11
H Donors
2
Rotatable Bonds
7
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 104987-16-8 | 23,24-Anhydro Tacrolimus | A2B Chem | ₹ 1,65,387.48 |
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/toxic.svg
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₄H₆₇NO₁₁
Molecular Weight: 786.00
Synonyms: delta23-FK-506
SMILES: CO[C@@H]1[C@]2([H])O[C@]([C@@H](C1)C)(C(C(N3[C@](CCCC3)([H])C(O[C@@H]([C@@H](/C=C/C([C@@H](/C=C(C[C@@H](C[C@@H]2OC)C)\C)CC=C)=O)C)/C(C)=C/[C@H]4C[C@H]([C@@H](CC4)O)OC)=O)=O)=O)O
Tpsa: 158.13
Logp: 5.4442
H Acceptors: 11
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₄H₆₇NO₁₁
Molecular Weight:
786.00
Synonyms:
delta23-FK-506
SMILES:
CO[C@@H]1[C@]2([H])O[C@]([C@@H](C1)C)(C(C(N3[C@](CCCC3)([H])C(O[C@@H]([C@@H](/C=C/C([C@@H](/C=C(C[C@@H](C[C@@H]2OC)C)\C)CC=C)=O)C)/C(C)=C/[C@H]4C[C@H]([C@@H](CC4)O)OC)=O)=O)=O)O
Tpsa:
158.13
Logp:
5.4442
H Acceptors:
11
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉NO₂
Molecular Weight: 151.16
Synonyms: None
SMILES: O=C1C=CC2=C(CCOC2)N1
Tpsa: 42.09
Logp: 0.4476
H Acceptors: 2
H Donors: 1
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:
C₈H₉NO₂
Molecular Weight:
151.16
Synonyms:
None
SMILES:
O=C1C=CC2=C(CCOC2)N1
Tpsa:
42.09
Logp:
0.4476
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD26398882
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇ClIN₃OSi
Molecular Weight: 409.73
Synonyms: None
SMILES: ClC1=NC=NC2=C1C(I)=CN2COCC[Si](C)(C)C
Tpsa: 39.94
Logp: 4.0016
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
MFCD26398882
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₇ClIN₃OSi
Molecular Weight:
409.73
Synonyms:
None
SMILES:
ClC1=NC=NC2=C1C(I)=CN2COCC[Si](C)(C)C
Tpsa:
39.94
Logp:
4.0016
H Acceptors:
4
H Donors:
0
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: C₁₈H₁₈ClNS
Molecular Weight: 315.86
Synonyms: Chlorprothixene Impurity 4（Chlorprothixene EP Impurity D)
SMILES: CN(C)CC/C=C1C2=CC=CC(Cl)=C2SC3=CC=CC=C3\1
Tpsa: 3.24
Logp: 5.188
H Acceptors: 2
H Donors: 0
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:
C₁₈H₁₈ClNS
Molecular Weight:
315.86
Synonyms:
Chlorprothixene Impurity 4（Chlorprothixene EP Impurity D)
SMILES:
CN(C)CC/C=C1C2=CC=CC(Cl)=C2SC3=CC=CC=C3\1
Tpsa:
3.24
Logp:
5.188
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3