기본 정보
- CAS
171412-00-3- 표준 SMILES
C=CCO[C@@H]1O[C@H](COCc2ccccc2)[C@@H](O[C@H]2O[C@H](COCc3ccccc3)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1- InChIKey
CODQUCITTUJJHD-NNNVFDJUSA-N- 분자식
- C77H84O16
- 평균 분자량
- 1,265.5 g/mol
이름 및 식별자
- 우선 이름
- 2-Propenyl O-2,3-Bis-O-(phenylmethyl)-alpha-D-glucopyranosyl-(1-->4)-O-2,3,6-tris-O-(phenylmethyl)-alpha-D-glucopyranosyl-(1-->4)-2,3,6-tris-O-(phenylmethyl)-beta-D-glucopyranoside
- IUPAC
- (2R,3R,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-6-prop-2-enoxyoxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-(hydroxymethyl)-4,5-bis(phenylmethoxy)oxan-3-ol
- 영어명
- 2-Propenyl O-2,3-Bis-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-O-2,3,6-tris-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-2,3,6-tris-O-(phenylmethyl)-β-D-glucopyranoside
- 분자식
- C77H84O16
- 분자량
- 1265.48
이름 및 동의어
171412-00-32-Propenyl O-2,3-Bis-O-(phenylmethyl)-alpha-D-glucopyranosyl-(1-->4)-O-2,3,6-tris-O-(phenylmethyl)-alpha-D-glucopyranosyl-(1-->4)-2,3,6-tris-O-(phenylmethyl)-beta-D-glucopyranoside2-Propenyl O-2,3-Bis-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-O-2,3,6-tris-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-2,3,6-tris-O-(phenylmethyl)-β-D-glucopyranosideβ-D-Glucopyranoside, 2-propen-1-yl O-2,3-bis-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-O-2,3,6-tris-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-2,3,6-tris-O-(phenylmethyl)-
데이터베이스 식별자
- CAS
171412-00-3
물성
구조 계산 물성
- XLogP
- 10.5
- 극성 표면적
- 170 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 34
- 무거운 원자 수
- 93
- 형식 전하
- 0
- 복잡도
- 1,970
물리화학적 성질
- 밀도
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- 저장 조건
- -20 °C · -20°C Freezer
- 용해도
- 에 용해됨디클로로메탄, 에틸아세테이트
- 산도 계수 (pKa)
- 12.91 · 12.91±0.70(Predicted)
- 물리적 상태
- 기름
- 색상
- 무색의
화학 및 산업
응용 분야
용도2-Propenyl O-2,3-Bis-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-O-2,3,6-tris-O-(phenylmethyl)-α-D-glucopyranosyl-(1→4)-2,3,6-tris-O-(phenylmethyl)-β-D-glucopyranoside is an intermediate in synthesizing 6-α-D-Glucopyranosyl Maltotriose-13C6 (G419103), a labelled 6-α-D-Glucopyranosyl Maltotriose (G419100). Sugar composition of sake.
공급사1 곳
BOC Sciences16314854226 · [email protected]
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