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기본 정보
- CAS
113-78-0- 표준 SMILES
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O- InChIKey
GTYWGUNQAMYZPF-QPLNMOKZSA-N- 분자식
- C43H65N11O12S2
- 평균 분자량
- 992.192 g/mol
- 단동위원소 질량
- 991.42555852
이름 및 식별자
- 우선 이름
- Demoxytocin
- IUPAC
- 1-{(4R,7S,10S,13S,16S)-7-(2-Amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl}-L-prolyl-L-leucylglycinamide
- 영어명
- demoxytocin
- 분자식
- C43H65N11O12S2
- 분자량
- 992.17
이름 및 동의어
demoxytocinDeaminoxytocindeaminooxytocinDemossitocina [DCIT]demoxytocin USP/EP/BP(Deamino-Cys1)-Oxytocin1-(3-Mercaptopropionic acid)oxytocinGlycinamide, N-(3-mercapto-1-oxopropyl)-L-tyrosyl-L-isoleucyl-L-glutaminyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-disulfide1-[4-(2-amino-2-keto-ethyl)-7-(3-amino-3-keto-propyl)-13-(4-hydroxybenzyl)-3,6,9,12,15-pentaketo-10-sec-butyl-18,19-dithia-2,5,8,11,14-pentazacycloicosane-1-carbonyl]-N-[1-[(2-amino-2-keto-ethyl)carbamoyl]-3-methyl-butyl]pyrrolidine-2-carboxamideN-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[4-(2-amino-2-oxoethyl)-7-(3-amino-3-oxopropyl)-10-butan-2-yl-13-[(4-hydroxyphenyl)methyl]-3,6,9,12,15-pentaoxo-18,19-dithia-2,5,8,11,14-pentazacycloicosane-1-carbonyl]pyrrolidine-2-carboxamide
데이터베이스 식별자
- CAS
113-78-0- PubChem CID
- 449224
- DTXSID
DTXSID701016964- ChEMBL
CHEMBL435716、CHEMBL439044
물성
물리화학적 성질
- 끓는 점
- 1518.8 · 1518.8±65.0 °C(Predicted)
- 밀도
- 1.263 · 1.263±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 9.9 · 9.90±0.15(Predicted)
- 물리적 상태
- Solid
- 색상
- White to off-white
화학 및 산업
공급사10 곳
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
杭州思诺达医药科技有限责任公司0571-87213919 17306812703 · [email protected]
杭州专肽生物技术有限公司17342063383 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
苏州默迪夫生物科技有限公司18151592215 18516107567 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
杭州肽佳生物科技有限公司0571-87213919 15967184799 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
ANHUI BYERSEN BIOTECH CO. LTD+8617355064950 · [email protected]
南京肽研生物科技有限公司19961912513 19941518170 · [email protected]
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