CS-1001146
Tacrolimus Impurity 34
Manufacturer: ChemScene
CAS Number: 135635-50-6
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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
C₄₄H₆₉NO₁₁
Molecular Weight
788.02
Synonyms
None
SMILES
O=C1OC(C(=CC2CCC(O)C(OC)C2)C)C(C)CCC(=O)C(C=C(C)CC(C)CC(OC)C3OC(O)(C(=O)C(=O)N4CCCCC14)C(C)CC3OC)CC=C
Tpsa
158.13
Logp
5.6682
H Acceptors
11
H Donors
2
Rotatable Bonds
7
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₄₄H₆₉NO₁₁
Molecular Weight: 788.02
Synonyms: None
SMILES: O=C1OC(C(=CC2CCC(O)C(OC)C2)C)C(C)CCC(=O)C(C=C(C)CC(C)CC(OC)C3OC(O)(C(=O)C(=O)N4CCCCC14)C(C)CC3OC)CC=C
Tpsa: 158.13
Logp: 5.6682
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:
C₄₄H₆₉NO₁₁
Molecular Weight:
788.02
Synonyms:
None
SMILES:
O=C1OC(C(=CC2CCC(O)C(OC)C2)C)C(C)CCC(=O)C(C=C(C)CC(C)CC(OC)C3OC(O)(C(=O)C(=O)N4CCCCC14)C(C)CC3OC)CC=C
Tpsa:
158.13
Logp:
5.6682
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: C₁₄H₁₆O₃
Molecular Weight: 232.28
Synonyms: None
SMILES: C(C(OC)=O)[C@H]1C=2C3=C(C=CC2CC1)OCC3
Tpsa: 35.53
Logp: 2.2144
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:
C₁₄H₁₆O₃
Molecular Weight:
232.28
Synonyms:
None
SMILES:
C(C(OC)=O)[C@H]1C=2C3=C(C=CC2CC1)OCC3
Tpsa:
35.53
Logp:
2.2144
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: C₂₀H₂₅NO₃
Molecular Weight: 327.42
Synonyms: None
SMILES: OC(COC=1C=CC=CC1C=CC=2C=CC=C(OC)C2)CN(C)C
Tpsa: 41.93
Logp: 3.1669
H Acceptors: 4
H Donors: 1
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:
C₂₀H₂₅NO₃
Molecular Weight:
327.42
Synonyms:
None
SMILES:
OC(COC=1C=CC=CC1C=CC=2C=CC=C(OC)C2)CN(C)C
Tpsa:
41.93
Logp:
3.1669
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
8
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₄N₆O₆
Molecular Weight: 384.39
Synonyms: None
SMILES: C(OCOC(COC([C@H](C(C)C)N)=O)CO)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa: 180.6
Logp: -1.4626
H Acceptors: 11
H Donors: 4
Rotatable Bonds: 10
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₄N₆O₆
Molecular Weight:
384.39
Synonyms:
None
SMILES:
C(OCOC(COC([C@H](C(C)C)N)=O)CO)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa:
180.6
Logp:
-1.4626
H Acceptors:
11
H Donors:
4
Rotatable Bonds:
10