O-(2-아세트아미도-2-데옥시-D-글루코피라노실)-L-세린
O-(2-(Acetylamino)-2-deoxy-beta-D-glucopyranosyl)-L-serine
기본 정보
- CAS
17041-36-0- 표준 SMILES
CC(=O)N[C@H]1[C@H](OC[C@H](N)C(=O)O)O[C@H](CO)[C@@H](O)[C@@H]1O- InChIKey
REDMNGDGDYFZRE-YRMXFSIDSA-N- 분자식
- C11H20N2O8
- 평균 분자량
- 308.29 g/mol
- 단동위원소 질량
- 308.1219656
개요
3-O-(N-acetyl-beta-D-glucosaminyl)-L-serine is an O-glycosyl-L-serine having N-acetyl-beta-D-glucosaminyl as the glycosyl component. It is an O-glycosyl-L-serine, a monosaccharide derivative and a non-proteinogenic L-alpha-amino acid.
이름 및 식별자
- 우선 이름
- O-(2-(Acetylamino)-2-deoxy-beta-D-glucopyranosyl)-L-serine
- IUPAC
- (2S)-3-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-aminopropanoic acid
- 현지명
- O-(2-아세트아미도-2-데옥시-D-글루코피라노실)-L-세린
- 영어명
- O-(2-Acetamido-2-deoxy-D-glucopyranosyl)-L-serine
- 분자식
- C11H20N2O8
- 분자량
- 308.29
이름 및 동의어
17041-36-0O-Seryl-beta-N-acetylglucosaminide3-O-(2-Acetamido-2-deoxy-beta-D-glucopyranosyl)-L-serineDTXSID40168855O-[2-(Acetylamino)-2-deoxy-beta-D-glucopyranosyl]-L-serineO-(2-(Acetylamino)-2-deoxy-beta-D-glucopyranosyl)-L-serineRefChem:928018DTXCID6091346O-(2-Acetamido-2-deoxy-D-glucopyranosyl)-L-serine(2S)-3-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-aminopropanoic acid3-O-(N-acetyl-beta-D-glucosaminyl)-L-serineO-((2R,3R,4R,5S,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-L-serine
이름 더 보기
O-(2-아세트아미도-2-데옥시-D-글루코피라노실)-L-세린2-Acetamido-2-deoxy-D-glucopyranosyl serine2-?Acetamido-?2-?deoxy-?β-D-?glucopyranosyl L-serineL-SERINE,O-[2-(ACETYLAMINO)-2-DEOXY-B-D-GLUCOPYRANOSYL]-L-Serine, O-[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]-(S)-3-[[(2R,3R,4R,5S,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy]-2-aminopropanoic Acid
물성
구조 계산 물성
- XLogP
- -5.6
- 극성 표면적
- 172 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 379
물리화학적 성질
- 끓는 점
- 701.2 · 701.2±60.0 °C(Predicted)
- 밀도
- 1.51 · 1.51±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 2.05 · 2.05±0.10(Predicted)
화학 및 산업
추가 설명
정의ChEBI: An O-glycosyl-L-serine having N-acetyl-beta-D-glucosaminyl as the glycosyl component.
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