식별 정보
Pentoxifylline EP Impurity J
CAS 874747-30-5 · C26H34N8O5
01식별 정보
| LazyChem ID | LC-24895 |
|---|---|
| CAS RN | 874747-30-5 |
| PubChem CID | 71750148 |
| 분자식 | C26H34N8O5 |
| 분자량 | 538.60 g/mol |
| IUPAC 명 | 1-[(5E)-11-(3,7-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)-5-methyl-7-oxoundec-5-enyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| InChIKey | JZAQVESYNLRDBT-SAPNQHFASA-N |
02구조 및 입체화학
2D 구조PubChem CID 71750148

| 분자식 | C26H34N8O5 |
|---|---|
| InChIKey | JZAQVESYNLRDBT-SAPNQHFASA-N |
| 고리 수 | 4 |
| 정의된 입체중심 | 0 |
| 미지정 입체중심 | 0 |
| SMILES | C/C(=C\C(=O)CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)/CCCCN3C(=O)C4=C(N=CN4C)N(C3=O)C |
|---|---|
| InChI | InChI=1S/C26H34N8O5/c1-17(10-6-8-12-33-23(36)19-21(27-15-29(19)2)31(4)25(33)38)14-18(35)11-7-9-13-34-24(37)20-22(28-16-30(20)3)32(5)26(34)39/h14-16H,6-13H2,1-5H3/b17-14+ |
03인도 규제 상태
정확한 화합물만 공개 식별자와 비교합니다. 규제 결정을 내리기 전에 현재 공식 문서를 확인하십시오.
04이름 및 관계
원료의약품 및 모화합물
Pentoxifylline
불순물 및 관련 화합물이름 및 관계
- 1-[(E)-11-(3,7-dimethyl-2,6-dioxopurin-1-yl)-5-methyl-7-oxoundec-5-enyl]-3,7-dimethylpurine-2,6-dione
- (E)-1,1'-(5-methyl-7-oxoundec-5-ene-1,11-diyl)bis(3,7-dimethyl-1H-purine-2,6(3H,7H)-dione)
- 1,1'-[(5E)-5-Methyl-7-oxo-5-undecene-1,11-diyl] Bis[Theobromine]
- (E)-1,1'-(5-Methyl-7-oxoundec-5-ene-1,11-diyl)bis(3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione)
- 1,1'-[(5E)-5-Methyl-7-oxoundec-5-ene-1,11-diyl]bis(3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione)
- 1-((5E)-11-(3,7-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)-5-methyl-7-oxoundec-5-enyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
- 1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-1-((5E)-5-methyl-7-oxo-11-(2,3,6,7-tetrahydro-3,7-dimethyl-2,6-dioxo-1H-purin-1-yl)-5-undecen-1-yl)-
- 3,7-Dihydro-3,7-dimethyl-1-((5E)-5-methyl-7-oxo-11-(2,3,6,7-tetrahydro-3,7-dimethyl-2,6-dioxo-1H-purin-1-yl)-5-undecen-1-yl)-1H-purine-2,6-dione
05출처
- S01PubChem CID 71750148
구조 및 기계 판독 가능한 화학 식별자.
