Ergosterol peroxide

CAS 2061-64-5 MFCD01746240

化学结构图

2061-64-5
SMILES: CC(C)[C@@H](C)/C=C/[C@@H](C)[C@@]1(O)CC[C@H]2[C@@]34C=C[C@]5(C[C@@H](O)CC[C@]5(C)[C@H]3CC[C@@]21C)OO4

化学属性

Mol. FormulaC28H44O3
Mol. Weight428.72

别名和识别编码

Chemical Name5-alpha,8-alpha-Ergosta-6,22-dien-3-beta-ol,5,8-epidioxy-
Synonym 3-hydroxy-5,7-epidioxyergosta-6,22-diene 5,8-Epidioxy-5-alpha,8-alpha-ergosta-6,22-dien-3-beta-ol 5,8-epidioxyergosta-6,22-dien-3-ol Ergosta-6,22-dien-3-ol, 5,8-epidioxy-, (3-beta,5-alpha,8-alpha,22E)- Ergosterol 5-alpha,8-alpha-epidioxide Ergosterol endoperoxide Ergosterol peroxide Peroxyergosterol ergosterol endoperoxide ergosterol peroxide ergosterol-5,8-peroxide
CAS Number2061-64-5
Beilstein Registry Number0096852
LabNetwork Molecule IDLN04729678
PubChem Substance ID5351516
InChIInChI=1S/C28H44O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,15-16,18-24,29H,9-14,17H2,1-6H3/b8-7+/t19-,20+,21-,22+,23+,24+,25+,26+,27+,28-/m0/s1
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安全信息

RTECSKE7289000 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 60 mg/kg
SEX/DURATION            : female 6-7 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - abortion
REFERENCE :
   JRPFA4 Journal of Reproduction and Fertility.  (Biochemical Soc. Book Depot,
   POB 32, Commerce Way, Colchester, Essex CO2 8HP, UK)  V.1-    1960-
   Volume(issue)/page/year: 46,461,1976

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 30 mg/kg
SEX/DURATION            : female 1 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - pre-implantation mortality (e.g. reduction in
   number of implants per female; total number of implants per corpora lutea)
REFERENCE :
   JRPFA4 Journal of Reproduction and Fertility.  (Biochemical Soc. Book Depot,
   POB 32, Commerce Way, Colchester, Essex CO2 8HP, UK)  V.1-    1960-
   Volume(issue)/page/year: 46,461,1976

系列性分类

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