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Lysocellin

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Name

Lysocellin

EINECS N/A
CAS No. 55898-33-4 Density 1.104g/cm3
PSA 151.98000 LogP 4.89920
Solubility N/A Melting Point N/A
Formula C34H60 O10 Boiling Point 722.8°Cat760mmHg
Molecular Weight 628.844 Flash Point 216°C
Transport Information N/A Appearance N/A
Safety Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating fumes. Risk Codes N/A
Molecular Structure Molecular Structure of 55898-33-4 (lysocellin) Hazard Symbols N/A
Synonyms

Lysocellin;2H-Pyran-2-acetic acid,6-[5-[5'-ethyloctahydro-2'-hydroxy-5'-(1-hydroxypropyl)-2,3',4-trimethyl[2,2'-bifuran]-5-yl]-2-hydroxy-1,3-dimethyl-4-oxoheptyl]tetrahydro-2-hydroxy-3,5-dimethyl-,[2S-[2a,3a,5a,6b[1R*,2R*,3R*,5S*[2R*[2'S*,3'S*,5'S*(R*)],4R*,5R*]]]]-;Stereoisomer of6-[5-[5'-ethyloctahydro-2'-hydroxy-5'-(1-hydroxypropyl)-2,3',4-trimethyl[2,2'-bifuran]-5-yl]-2-hydroxy-1,3-dimethyl-4-oxoheptyl]tetrahydro-2-hydroxy-3,5-dimethyl-2H-pyran-2-aceticacid

Article Data 1

Lysocellin Chemical Properties

Empirical Formula of Lysocellin (CAS NO.55898-33-4): C34H60O10
Molecular Weight: 628.8342 g/mol
Index of Refraction: 1.495
Density: 1.104 g/cm3
Flash Point: 216 °C
Enthalpy of Vaporization: 120.59 kJ/mol
Boiling Point: 722.8 °C at 760 mmHg
Vapour Pressure: 3.98E-24 mmHg at 25 °C
Structure of Lysocellin (CAS NO.55898-33-4):
                    
IUPAC Name: 2-[(2S,3R,5S,6S)-6-[(3S,4S,6R)-6-[(3S,5S)-5-[(2R,3R,5R)-5-Ethyl-2-hydroxy-5-[(1S)-1-hydroxypropyl]-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-3,5-dimethyloxan-2-yl]ethaneperoxoic acid
Canonical SMILES: CCC(C1C(CC(O1)(C)C2(C(CC(O2)(CC)C(CC)O)C)O)C)C(=O)C(C)C(C(C)C3C(CC(C(O3)
CC(=O)OO)C)C)O
Isomeric SMILES: CC[C@H](C1[C@H](C[C@@](O1)(C)[C@]2([C@@H](C[C@](O2)(CC)[C@H](CC)O)C)O)C)
C(=O)[C@@H](C)[C@H](C(C)[C@@H]3[C@H](C[C@H]([C@@H](O3)CC(=O)OO)C)C)O
InChIKey: QYWGMFHIXAJJEG-KAENHNMNSA-N
 

Lysocellin Toxicity Data With Reference

1.    

orl-mus LD50:350 mg/kg

    37ASAA    Kirk-Othmer Encyclopedia of Chemical Technology. 3 (1978),61.
2.    

ipr-mus LD50:65 mg/kg

    37ASAA    Kirk-Othmer Encyclopedia of Chemical Technology. 3 (1978),61.

Lysocellin Safety Profile

Poison by ingestion and intraperitoneal routes. When heated to decomposition Lysocellin (CAS NO.55898-33-4) emits acrid smoke and irritating fumes.

Lysocellin Specification

 Lysocellin ,its cas register number is 55898-33-4. It is drug and therapeutic agent as natural product.

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