Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 123740생성일: 2026년 11월 2일
부티로락톤I
부티로락톤I · OloMoucin · BUTYROLACTONE I · Butyrolactone I - CAS 87414-49-1 · Butyrolactone I, ATP-competitive cyclin-dependent kinase (CDK) inhibitor · 2,5-Dihydro-4-hydroxy-2-[4-hydroxy-3-(3-methyl-2-butenyl)benzyl]-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylic acid methyl ester · 2-Furancarboxylic acid, 2,5-dihydro-4-hydroxy-2-[[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]methyl]-3-(4-hydroxyphenyl)-5-oxo-, methyl ester, (2R)-
https://huagongshe.com/ko/chemical/123740
식별자 및 물리적 특성
| CAS No. | 87414-49-1 |
|---|
| 분자식 | C24H24O7 |
|---|
| 평균 분자량 | 424.449 g/mol |
|---|
| 단동위원소 질량 | 424.15220311 g/mol |
|---|
| SMILES | COC(=O)[C@]1(Cc2ccc(O)c(CC=C(C)C)c2)OC(=O)C(O)=C1c1ccc(O)cc1 |
|---|
| InChIKey | NGOLMNWQNHWEKU-XMMPIXPASA-N |
|---|
| PubChem CID | 123740 |
|---|
| ChEMBL | CHEMBL517026 |
|---|
| DTXSID | DTXSID50236337 |
|---|
| 현지명 | 부티로락톤I |
|---|
화학 및 물리적 성질
| 녹는점 | 74℃ |
|---|
| 끓는 점 | 660.1±55.0 °C(Predicted) |
|---|
| 밀도 | 1.353±0.06 g/cm3(Predicted) |
|---|
| 저장 조건 | Store at -20°C |
|---|
| 용해도 | 25mg/ml의 에탄올 또는 10mg/ml의 DMSO에 용해됨 |
|---|
| 물리적 상태 | 백색 고체. |
|---|
| pKa(산도 계수) | 8.59±0.40(Predicted) |
|---|
| 색상 | 흰색에서 황백색까지 |
|---|
| InChI | 1S/C24H24O7/c1-14(2)4-6-17-12-15(5-11-19(17)26)13-30-23(29)24(3)20(21(27)22(28)31-24)16-7-9-18(25)10-8-16/h4-5,7-12,25-27H,6,13H2,1-3H3/t24-/m1/s1 |
|---|
| InChIKey | FPVUCBMBMUHRDX-XMMPIXPASA-N |
|---|
안전 및 규제
| 수질 위해 등급(WGK) | WGK 3 |
|---|
| 관세 코드 | 29419000 |
|---|
| 저장 분류 | 11 - Combustible Solids |
|---|
용도
용도
Butyrolactone I is one of a family of three butyrolactones isolated from Aspergillus fumigatus, first reported in 1983. Butyrolactone I exhibits antitumor activity, inhibiting the cell cycle at the G1/S and G2/M transitions. Butyrolactone I is a selective inhibitor of cyclin-dependent kinases CDK1/cyclin B, CDK2 and CDK5, and is an important bioprobe for understanding the cellular roles of CDKs.
