기본 정보
- CAS
14684-37-8- 표준 SMILES
CCC1=C(C)C(Cc2[nH]c(Cc3[nH]c(CC4NC(=O)C(C)=C4CC)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)NC1=O- InChIKey
OBHRVMZSZIDDEK-UHFFFAOYSA-N- 분자식
- C33H44N4O6
- 평균 분자량
- 592.7 g/mol
- 단동위원소 질량
- 592.32608514
개요
Urobilinogen is a member of the class of bilanes that is a colourless product formed in the intestine by the reduction of bilirubin. It has a role as a human metabolite. It is a conjugate acid of a urobilinogen(2-).
이름 및 식별자
- 우선 이름
- 21H-Biline-8,12-dipropanoic acid, 2,17-diethyl-1,4,5,10,15,16,19,22,23,24-decahydro-3,7,13,18-tetramethyl-1,19-dioxo-
- IUPAC
- 3-[2-[[3-(2-carboxyethyl)-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(4-ethyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid
- 현지명
- 우로빌리노겐
- 영어명
- UROBILINOGEN
- 분자식
- C33H44N4O6
- 분자량
- 592.73
이름 및 동의어
UROBILINOGEN14684-37-821H-Biline-8,12-dipropanoic acid, 2,17-diethyl-1,4,5,10,15,16,19,22,23,24-decahydro-3,7,13,18-tetramethyl-1,19-dioxo-PY8N5V3S0DDTXSID601105823CHEBI:29026RefChem:193315DTXCID201537490604-544-5i-UrobilinogenMesobilirubinogenurobilinogen IXalpha
이름 더 보기
우로빌리노겐C05790stercobilinogen21H-Biline-8,12-dipropanoic acid, 2,17-diethyl-1,4,5,10,15,16,19,22,23,24-decahydro-3,7,13,18-tetramethyl-1,19-dioxo- (9CI)3-(2-((3-(2-Carboxyethyl)-5-((3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)methyl)-4-methyl-1H-pyrrol-2-yl)methyl)-5-((4-ethyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)methyl)-4-methyl-1H-pyrrol
mesobilirubinogen IXalphaUrobilinogen, kristallinURINARY UROBILINOGEN3-(2-((3-(2-Carboxyethyl)-5-((3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)methyl)-4-methyl-1H-pyrrol-2-yl)methyl)-5-((4-ethyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)methyl)-4-methyl-1H-pyrrol-3-yl)propanoic acidUNII-PY8N5V3S0D3-[2-[[3-(2-carboxyethyl)-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(4-ethyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acidSCHEMBL132233orb2943003
물성
구조 계산 물성
- XLogP
- 2.7
- 극성 표면적
- 164 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 1,160
실험 및 물리화학적 성질
LogP1.969
Physical DescriptionSolid
물리화학적 성질
- 끓는 점
- 870.4 · 870.4±65.0 °C(Predicted)
- 밀도
- 1.235 · 1.235±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 4.68 · 4.68±0.10(Predicted)
화학 및 산업
약리 정보
Cellular LocationsMembrane
공급사8 곳
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
Aladdin Scientific[email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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