CS-0012998

2-((4R,5S,6S,7R,9R,11E,13E,15R,16R)-6-(((3S,4S,5S,6S)-4-(Dimethylamino)-3,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-16-ethyl-4-hydroxy-5,9,13-trimethyl-2,10-dioxo-15-(((phenylsulfonyl)oxy)methyl)oxacyclohexadeca-11,13-dien-7-yl)ethyl benzenesulfonate

Manufacturer: ChemScene

CAS Number: None

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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

C₄₃H₆₁NO₁₄S₂

Molecular Weight

880.07

Synonyms

None

SMILES

O=C(/C=C/C(C)=C/[C@H](COS(=O)(C1=CC=CC=C1)=O)[C@@H](CC)O2)[C@H](C)C[C@H](CCOS(=O)(C3=CC=CC=C3)=O)[C@H](OC4[C@@H](O)[C@@H](N(C)C)[C@H](O)[C@H](C)O4)[C@@H](C)[C@H](O)CC2=O

Tpsa

212.5

Logp

4.0222

H Acceptors

15

H Donors

3

Rotatable Bonds

13

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SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

Precautionary Statements

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Compare Similar Items

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Img

ChemScene

CS-0012998

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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:
C₄₃H₆₁NO₁₄S₂

Molecular Weight:
880.07

Synonyms:
None

SMILES:
O=C(/C=C/C(C)=C/[C@H](COS(=O)(C1=CC=CC=C1)=O)[C@@H](CC)O2)[C@H](C)C[C@H](CCOS(=O)(C3=CC=CC=C3)=O)[C@H](OC4[C@@H](O)[C@@H](N(C)C)[C@H](O)[C@H](C)O4)[C@@H](C)[C@H](O)CC2=O

Tpsa:
212.5

Logp:
4.0222

H Acceptors:
15

H Donors:
3

Rotatable Bonds:
13

Img

ChemScene

CS-0013002

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Purity:
98%

MDL No:
MFCD00085683

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₀H₁₀O₄

Molecular Weight:
194.18

Synonyms:
Cresopyrine; NSC 49105; AGN 357; Acetyl-o-cresotic acid; 2-(Acetyloxy)-3-methylbenzoic acid

SMILES:
O=C(O)C1=CC=CC(C)=C1OC(C)=O

Tpsa:
63.6

Logp:
1.61852

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-0013006

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Purity:
97%

MDL No:
None

Storage:
4°C

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₀H₉ClN₂

Molecular Weight:
192.64

Synonyms:
5-Chloro-3-methyl-1-phenylpyrazole

SMILES:
CC(C=C1Cl)=NN1C2=CC=CC=C2

Tpsa:
17.82

Logp:
2.83412

H Acceptors:
2

H Donors:
0

Rotatable Bonds:
1

Img

ChemScene

CS-0013012

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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:
C₅H₉NNa₂O₇

Molecular Weight:
241.11

Synonyms:
Propanedioic acid, (acetylamino)-, disodium salt dihydrate

SMILES:
O=C(O[Na])C(NC(C)=O)C(O[Na])=O.O.O

Tpsa:
144.7

Logp:
-3.9049

H Acceptors:
5

H Donors:
1

Rotatable Bonds:
3