기본 정보
- CAS
980-21-2- 표준 SMILES
NC(Cc1ccc(O)c(-c2cc(CC(N)C(=O)O)ccc2O)c1)C(=O)O- InChIKey
OQALFHMKVSJFRR-UHFFFAOYSA-N- 분자식
- C18H20N2O6
- 평균 분자량
- 360.4 g/mol
- 단동위원소 질량
- 360.13213636
개요
Dityrosine is a biphenyl compound comprising two tyrosine residues linked at carbon-3 of their benzene rings. It has a role as a biomarker. It is a member of biphenyls, a tyrosine derivative and a non-proteinogenic alpha-amino acid.
이름 및 식별자
- 우선 이름
- Dityrosine
- IUPAC
- 2-amino-3-[3-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]-4-hydroxyphenyl]propanoic acid
- 영어명
- 2-amino-3-[3-[5-(2-amino-3-hydroxy-3-oxopropyl)-2-hydroxyphenyl]-4-hydroxyphenyl]propanoic acid
- 분자식
- C18H20N2O6
- 분자량
- 360.36
이름 및 동의어
Dityrosine980-21-2o,o-DityrosineBityrosineCHEBI:50607DTXSID101318376alpha,alpha'-Diamino-6,6'-dihydroxy-(1,1'-biphenyl)-3,3'-dipropanoic acidRefChem:135228DTXCID101748187Dityrosine Dihydrochloride3,3'-(6,6'-dihydroxy-[1,1'-biphenyl]-3,3'-diyl)bis(2-aminopropanoic acid)LL-dityrosine
이름 더 보기
3,3'-dityrosineo,o-Dityrosine HCl[1,1'-Biphenyl]-3,3'-dipropanoicacid, a3,a3'-diaMino-6,6'-dihydroxy-[1,1'-Biphenyl]-3,3'-dipropanoic acid, α3,α3'-diamino-6,6'-dihydroxy-2-Amino-3-(3-[5-(2-amino-2-carboxyethyl)-2-hydroxybiphenyl]-4-hydroxyphenyl)propanoic acid
2-Amino-3-[5'-(2-amino-2-carboxy-ethyl)-6,2'-dihydroxy-biphenyl-3-yl]-propionic acid2-amino-3-[3-[5-(2-amino-3-hydroxy-3-oxopropyl)-2-hydroxyphenyl]-4-hydroxyphenyl]propanoic acid2-amino-3-[3-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]-4-hydroxyphenyl]propanoic acid2-amino-3-[3-[5-(2-amino-2-carboxy-ethyl)-2-hydroxy-phenyl]-4-hydroxy-phenyl]propanoic acid221308-01-6980-21-2(free base)SCHEMBL3380683 ,3'-Bityrosine hydrochloride
물성
구조 계산 물성
- XLogP
- -3.8
- 극성 표면적
- 167 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 458
물리화학적 성질
- 끓는 점
- 622.9 · 622.9±55.0 °C(Predicted)
- 밀도
- 1.455 · 1.455±0.06 g/cm3(Predicted)
- 용해도
- 산성수(약간 용해됨), 메탄올(약간 용해됨), 물(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 1.94 · 1.94±0.20(Predicted)
- 색상
- 미색부터 페일 베이지까지
- 안정성
- 흡습성
화학 및 산업
공급사14 곳
杭州品高化工有限公司0571-87658025 · [email protected]
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Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
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天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
上海指月生物科技有限公司13918644899 · [email protected]
上海旺珐化工科技有限公司（安徽珐诺伊医药科技有限公司）13918479294 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
上海索本生物科技有限公司13023173052 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
上海雅吉生物科技有限公司021-34661275 15301693058 · [email protected]
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