4-METHYLUMBELLIFERYL-§-D-셀로테트로사이드
4-Methylumbelliferyl b-D-cellotetraoside
기본 정보
- CAS
84325-19-9- 표준 SMILES
Cc1cc(=O)oc2cc(O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO)[C@@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@@H](O)[C@H](O)C6O)[C@H](O)C5O)[C@H](O)C4O)[C@H](O)C3O)ccc12- InChIKey
VLSZKXHJJYJMLH-VTVLNYHISA-N- 분자식
- C34H48O23
- 평균 분자량
- 824.7 g/mol
- 단동위원소 질량
- 824.25863777
이름 및 식별자
- 우선 이름
- 4-Methylumbelliferyl b-D-cellotetraoside
- IUPAC
- 7-[(2S,4R,5S)-5-[(2S,4R,5S)-5-[(2S,4R,5S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-methylchromen-2-one
- 현지명
- 4-METHYLUMBELLIFERYL-§-D-셀로테트로사이드
- 영어명
- 4-Methylumbelliferyl-§-D-cellotetroside
- 분자식
- C34H48O23
- 분자량
- 824.73112
이름 및 동의어
84325-19-94-Methylumbelliferyl b-D-cellotetraoside7-[(2S,4R,5S)-5-[(2S,4R,5S)-5-[(2S,4R,5S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-methylchromen-2-one7-(((2S,4R,5S)-5-(((2S,4R,5S)-5-(((2S,4R,5S)-3,4-dihydroxy-6-(hydroxymethyl)-5-(((2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4-methyl-2H-chromen-2-one4-Methylumbelliferyl |A-D-Cellotetroside4-METHYLUMBELLIFERYL BETA-D-CELLOTETROSIDEDTXSID50858114C34H48O23EM04814CS-04560854-Methyl-2-oxo-2H-1-benzopyran-7-yl beta-D-threo-hexopyranosyl-(1->4)-beta-D-threo-hexopyranosyl-(1->4)-beta-D-threo-hexopyranosyl-(1->4)-beta-D-threo-hexopyranoside7-[(2S,4R,5S)-5-[(2S,4R,5S)-5-[(2S,4R,5S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4-methyl-chromen-2-one
물성
구조 계산 물성
- XLogP
- -7.2
- 극성 표면적
- 363 Ų
- 수소 결합 공여자 수
- 13
- 수소 결합 수용자 수
- 23
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 57
- 형식 전하
- 0
- 복잡도
- 1,360
물리화학적 성질
- 녹는점
- 309 · 309-311°C
- 끓는 점
- 1148.7 · 1148.7±65.0 °C(Predicted)
- 밀도
- 1.75 · 1.75±0.1 g/cm3(Predicted)
- 저장 조건
- Refrigerator
- 용해도
- 에 용해됨물
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 12.61 · 12.61±0.70(Predicted)
- 색상
- 흰색에서 황백색까지
화학적 성질
White Solid
화학 및 산업
응용 분야
용도4-Methylumbelliferyl β-D-Cellotetroside (cas# 84325-19-9) is a compound useful in organic synthesis.
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…