[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6,14-dihydroxy-5,6-dimethyl-,(3Z,5R,6R,14R,14aS,14bR)-

Modify Date: 2025-09-24 18:43:29

[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6,14-dihydroxy-5,6-dimethyl-,(3Z,5R,6R,14R,14aS,14bR)- Structure
[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6,14-dihydroxy-5,6-dimethyl-,(3Z,5R,6R,14R,14aS,14bR)- structure
Common Name [1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6,14-dihydroxy-5,6-dimethyl-,(3Z,5R,6R,14R,14aS,14bR)-
CAS Number 5096-49-1 Molecular Weight 351.39400
Density 1.32g/cm3 Boiling Point 610.3ºC at 760 mmHg
Molecular Formula C18H25NO6 Melting Point N/A
MSDS N/A Flash Point 322.9ºC

 Names

Name Anacrotine

 Chemical & Physical Properties

Density 1.32g/cm3
Boiling Point 610.3ºC at 760 mmHg
Molecular Formula C18H25NO6
Molecular Weight 351.39400
Flash Point 322.9ºC
Exact Mass 351.16800
PSA 96.30000
LogP 0.10150
Index of Refraction 1.587
InChIKey NPYPUYCITBTPSF-TZCAYXSXSA-N
SMILES CC=C1CC(C)C(C)(O)C(=O)OCC2=CCN3CC(O)C(OC1=O)C23

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VT5707000
CHEMICAL NAME :
Senecionan-11,16-dione, 6,12-dihydroxy-, (6-beta)-
CAS REGISTRY NUMBER :
5096-49-1
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H25-N-O6

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
70 mg/kg
TOXIC EFFECTS :
Liver - other changes
REFERENCE :
CBINA8 Chemico-Biological Interactions. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1969- Volume(issue)/page/year: 12,299,1976
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