Verrucarin A, 7-(1-(acetyloxy)ethyl)-7-deoxo-2-deoxy-3,4-dihydroxy-

Modify Date: 2025-09-22 19:06:02

Verrucarin A, 7-(1-(acetyloxy)ethyl)-7-deoxo-2-deoxy-3,4-dihydroxy- Structure
Verrucarin A, 7-(1-(acetyloxy)ethyl)-7-deoxo-2-deoxy-3,4-dihydroxy- structure
Common Name Verrucarin A, 7-(1-(acetyloxy)ethyl)-7-deoxo-2-deoxy-3,4-dihydroxy-
CAS Number 93633-91-1 Molecular Weight 590.65900
Density 1.32g/cm3 Boiling Point 790.8ºC at 760 mmHg
Molecular Formula C31H42O11 Melting Point N/A
MSDS N/A Flash Point 253.3ºC

 Names

Name Verrucarin A, 3'-(acetyloxy)-7'-deoxo-2'-deoxy-4'-hydroxy-7'-(1-hydroxyethyl)
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.32g/cm3
Boiling Point 790.8ºC at 760 mmHg
Molecular Formula C31H42O11
Molecular Weight 590.65900
Flash Point 253.3ºC
Exact Mass 590.27300
PSA 150.35000
LogP 2.07910
Index of Refraction 1.579
InChIKey XGOQVDSNQJJHTN-VRHVFUOLSA-N
SMILES CC(=O)OC1(C)CC(=O)OCC23CCC(C)=CC2OC2CC(OC(=O)C=CC=CC(C(C)O)OCC1O)C3(C)C21CO1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YX9820500
CHEMICAL NAME :
Verrucarin A, 3'-(acetyloxy)-7'-deoxo-2'-deoxy-4'-hydroxy-7'-(1-hyd roxyethyl)-
CAS REGISTRY NUMBER :
93633-91-1
LAST UPDATED :
198611
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C31-H42-O11
MOLECULAR WEIGHT :
590.73

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
50 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold Behavioral - muscle contraction or spasticity
REFERENCE :
TOXIA6 Toxicon. (Pergamon Press Ltd., Headington Hill Hall, Oxford OX3 OBW, UK) V.1- 1962- Volume(issue)/page/year: 23,731,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
18 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold Behavioral - muscle contraction or spasticity
REFERENCE :
TOXIA6 Toxicon. (Pergamon Press Ltd., Headington Hill Hall, Oxford OX3 OBW, UK) V.1- 1962- Volume(issue)/page/year: 23,731,1985

 Synonyms

Miotoxin C
(7'R)-3'-(Acetyloxy)-7'-deoxo-2'-deoxy-4'-hydroxy-7'-(1-hydroxyethyl)verrucarin A
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