기본 정보
- CAS
93496-44-7- 표준 SMILES
CC(=O)N[C@H]1[C@@H](OCc2ccccc2)O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H]1O- InChIKey
AJWSWORSAKFGER-HKPIRTJOSA-N- 분자식
- C21H31NO11
- 평균 분자량
- 473.5 g/mol
- 단동위원소 질량
- 473.1897108
이름 및 식별자
- 우선 이름
- Benzyl 2-Acetamido-2-deoxy-6-O-(beta-D-galactopyranosyl)-alpha-D-galactopyranoside
- IUPAC
- N-[(2S,3R,4R,5R,6R)-4,5-dihydroxy-2-phenylmethoxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide
- 현지명
- 벤질2-ACETAMIDO-2-DEOXY-6-O-(BETA-D-GALACTOPYRANOSYL)-ALPHA-D-GALACTOPYRANOSIDE
- 영어명
- BENZYL 2-ACETAMIDO-2-DEOXY-6-O-(BETA-D-GALACTOPYRANOSYL)-ALPHA-D-GALACTOPYRANOSIDE
- 분자식
- C21H31NO11
- 분자량
- 473.47
이름 및 동의어
93496-44-7Benzyl 2-Acetamido-2-deoxy-6-O-(beta-D-galactopyranosyl)-alpha-D-galactopyranosideN-[(2S,3R,4R,5R,6R)-4,5-dihydroxy-2-phenylmethoxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamideBenzyl 2-acetamido-2-deoxy-6-O-(b-D-galactopyranosyl)-a-D-galactopyranoside-?-D-galactopyranosideBenzyl 2-Acetamido-2-deoxy-6-O-(|A-D-galactopyranosyl)-|A-D-galactopyranosideorb2941491TSW-00540CS-0807153Benzyl 2-Acetamido-2-deoxy-6-O-(?-D-galactopyranosyl)N-((2S,3R,4R,5R,6R)-2-(Benzyloxy)-4,5-dihydroxy-6-((((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3-yl)acetamide벤질2-ACETAMIDO-2-DEOXY-6-O-(BETA-D-GALACTOPYRANOSYL)-ALPHA-D-GALACTOPYRANOSIDE
이름 더 보기
Galβ1→6GalNAcα-BnBenzyl 2-Acetamido-2-deoxy-6-O-(β-D-galactopyranosyl) -α-D-galactopyranosidePhenylMethyl 2-(AcetylaMino)-2-deoxy-6-O-β-D-galactopyranosyl-α-D-galactopyranosideα-D-Galactopyranoside, phenylmethyl 2-(acetylamino)-2-deoxy-6-O-β-D-galactopyranosyl-Benzyl 2-Acetamido-2-deoxy-6-O-(β-D-galactopyranosyl)-α-D-galactopyranoside, CAS 93496-44-7
데이터베이스 식별자
- CAS
93496-44-7- PubChem CID
- 71313746
물성
구조 계산 물성
- XLogP
- -2.8
- 극성 표면적
- 187 Ų
- 수소 결합 공여자 수
- 7
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 619
물리화학적 성질
- 녹는점
- 219 · 219-224°C dec.
- 저장 조건
- -20 °C · -20°C Freezer
- 용해도
- 메탄올(약간 용해됨), 물(약간 용해됨)
- 물리적 상태
- 고체
- 색상
- 흰색에서 황백색까지
화학적 성질
Off White Solid
화학 및 산업
공급사4 곳
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