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Substance Name: 1,4-Benzenedicarboxylic acid, bis(3-(octahydro-1-methylcyclopenta(b)pyrrol-2-yl)propyl) ester, dihydrochloride, (2-alpha(2S*,3aR*,6aR*),3a-beta,6a-beta)-
RN: 125503-51-7
InChIKey: UPQOOBUDXHJODZ-CQLLOFCBSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C30-H44-N2-O4.2Cl-H
Molecular Weight
- 569.6094
Names and Synonyms
Synonym
- Bis(3-(1-methyl-2-cyclopenta(b)pyrrolidinyl)-1-propyl)terephthalate dihydrochloride
Systematic Name
- 1,4-Benzenedicarboxylic acid, bis(3-(octahydro-1-methylcyclopenta(b)pyrrol-2-yl)propyl) ester, dihydrochloride, (2-alpha(2S*,3aR*,6aR*),3a-beta,6a-beta)-
Registry Numbers
CAS Registry Number
- 125503-51-7
System Generated Number
- 0125503517
Molecular Formulas
Molecular Formula
- C30-H44-N2-O4.2Cl-H
Molecular Formula Fragments
- C30-H44-N2-O4
- Cl-H
- COMPONENT
Structure Descriptors
InChI
1S/C30H44N2O4.2ClH/c1-31-25(19-23-7-3-11-27(23)31)9-5-17-35-29(33)21-13-15-22(16-14-21)30(34)36-18-6-10-26-20-24-8-4-12-28(24)32(26)2;;/h13-16,23-28H,3-12,17-20H2,1-2H3;2*1H/t23-,24?,25+,26?,27-,28?;;/m0../s1InChIKey
UPQOOBUDXHJODZ-CQLLOFCBSA-NSmiles
CN1[C@H]2CCC[C@H]2C[C@H]1CCCOC(=O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 100ug/kg (0.1mg/kg) | Pharmaceutical Chemistry Journal Vol. 23, Pg. 588, 1989. |