Octanoic acid,octahydro-3a,5,5-trimethyl-2,7-dioxospiro[cyclopenta[4,5]pentaleno[1,6a-b]oxirene-3(3aH),2'-oxiran]-4-ylester, [1aS-(1aa,3b,3ab,3ba,4a,6aa,7aR*)]- (9CI)
Names
[ CAS No. ]:
34864-30-7
[ Name ]:
Octanoic acid,octahydro-3a,5,5-trimethyl-2,7-dioxospiro[cyclopenta[4,5]pentaleno[1,6a-b]oxirene-3(3aH),2'-oxiran]-4-ylester, [1aS-(1aa,3b,3ab,3ba,4a,6aa,7aR*)]- (9CI)
[Synonym ]:
coriolin b,diketo
Chemical & Physical Properties
[ Density]:
1.24g/cm3
[ Boiling Point ]:
528.6ºC at 760mmHg
[ Molecular Formula ]:
C23H32O6
[ Molecular Weight ]:
404.49700
[ Flash Point ]:
228.7ºC
[ Exact Mass ]:
404.22000
[ PSA ]:
85.50000
[ LogP ]:
2.99930
[ Index of Refraction ]:
1.551
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- RH0780500
- CHEMICAL NAME :
- Octanoic acid, octahydro-3a,5,5-trimethyl-2,7-dioxospiro(cyclopenta( 4,5)pentaleno(1,6a-be ta) oxirene-3(3ah),2'-oxiran)-4-yl ester, (1a-alpha,3-beta,3a-beta,3b-alpha,4-alpha,6a- alpha,7ar*)-
- CAS REGISTRY NUMBER :
- 34864-30-7
- LAST UPDATED :
- 199310
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C23-H32-O6
- MOLECULAR WEIGHT :
- 404.55
- WISWESSER LINE NOTATION :
- T C5553 1A L BV IXV LOTJ E1 E1 FOV7 H1 I-& BT3OX CHJ
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 40 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 24,631,1971
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >80 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 24,631,1971 ** OTHER MULTIPLE DOSE TOXICITY DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 200 mg/kg/10D-C
- TOXIC EFFECTS :
- Related to Chronic Data - death
- REFERENCE :
- JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 24,631,1971
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 200 mg/kg/10D-I
- TOXIC EFFECTS :
- Related to Chronic Data - death
- REFERENCE :
- JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 24,631,1971
Related Compounds
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