CS-0913989
(3R,4S,5S,6R,7R,9R,11S,12R,13S,14R,E)-6-(((2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-14-ethyl-7,12,13-trihydroxy-4-(((2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy)-10-(hydroxyimino)-3,5,7,9,11,13-hexamethyloxacyclotetradecan-2-one hydrochloride
Manufacturer: ChemScene
CAS Number: 145645-54-1
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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
C₃₇H₆₉ClN₂O₁₃
Molecular Weight
785.40
Synonyms
None
SMILES
O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3.Cl
Tpsa
209.43
Logp
2.4685
H Acceptors
15
H Donors
6
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: C₃₇H₆₉ClN₂O₁₃
Molecular Weight: 785.40
Synonyms: None
SMILES: O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3.Cl
Tpsa: 209.43
Logp: 2.4685
H Acceptors: 15
H Donors: 6
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:
C₃₇H₆₉ClN₂O₁₃
Molecular Weight:
785.40
Synonyms:
None
SMILES:
O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3.Cl
Tpsa:
209.43
Logp:
2.4685
H Acceptors:
15
H Donors:
6
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: C₂₂H₁₅N₃O₃
Molecular Weight: 369.37
Synonyms: None
SMILES: N#CC=1C=CC=CC1C=2C=CC(=CC2)CN3C(=O)NC4=CC=CC(C(=O)O)=C43
Tpsa: 98.88
Logp: 3.61478
H Acceptors: 4
H Donors: 2
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:
C₂₂H₁₅N₃O₃
Molecular Weight:
369.37
Synonyms:
None
SMILES:
N#CC=1C=CC=CC1C=2C=CC(=CC2)CN3C(=O)NC4=CC=CC(C(=O)O)=C43
Tpsa:
98.88
Logp:
3.61478
H Acceptors:
4
H Donors:
2
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: C₂₂H₁₇N₃O₄
Molecular Weight: 387.39
Synonyms: None
SMILES: O=C(O)C=1C=CC=C2NC(=O)N(C21)CC=3C=CC(=CC3)C=4C=CC=CC4C(=O)N
Tpsa: 118.18
Logp: 2.842
H Acceptors: 4
H Donors: 3
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:
C₂₂H₁₇N₃O₄
Molecular Weight:
387.39
Synonyms:
None
SMILES:
O=C(O)C=1C=CC=C2NC(=O)N(C21)CC=3C=CC(=CC3)C=4C=CC=CC4C(=O)N
Tpsa:
118.18
Logp:
2.842
H Acceptors:
4
H Donors:
3
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: C₇Cl₂F₄N₂
Molecular Weight: 258.99
Synonyms: None
SMILES: N#CC1=C(C(F)(F)F)C(F)=C(Cl)N=C1Cl
Tpsa: 36.68
Logp: 3.41798
H Acceptors: 2
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:
C₇Cl₂F₄N₂
Molecular Weight:
258.99
Synonyms:
None
SMILES:
N#CC1=C(C(F)(F)F)C(F)=C(Cl)N=C1Cl
Tpsa:
36.68
Logp:
3.41798
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0