기본 정보
- 표준 SMILES
O=P(O)(O)OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O- InChIKey
NBSCHQHZLSJFNQ-VFUOTHLCSA-N- 분자식
- C6H13O9P
- 평균 분자량
- 260.14 g/mol
- 단동위원소 질량
- 260.02971863
개요
Beta-D-glucose 6-phosphate is a D-glucopyranose 6-phosphate in which the anomeric centre has beta-configuration. It has a role as an epitope and a mouse metabolite. It is functionally related to a beta-D-glucose. It is a conjugate acid of a beta-D-glucose 6-phosphate(2-).
이름 및 식별자
- 우선 이름
- Beta-D-Glucose 6-phosphate
- IUPAC
- [(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl dihydrogen phosphate
이름 및 동의어
beta-D-Glucose 6-phosphatebeta-D-glucose-6-phosphate6-H2PO3Glcbeta6-O-phosphono-beta-D-glucopyranosebeta-D-glucose 6-(dihydrogen phosphate)beta-D-Glucose 6-phosphic acidCHEBI:17719{[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy}phosphonic acid(((2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl)methoxy)phosphonic acidRefChem:937500GlyTouCan:G25562BMG25562BM
이름 더 보기
methylidene((3,4,5,6-tetrahydroxyoxan-2-yl)methoxy)phosphoniteG6FRT62N3J15209-12-8beta-D-Glucopyranose 6-phosphateUNII-G6FRT62N3JCHEMBL257975beta-D-Glucopyranose, 6-(dihydrogen phosphate).beta.-D-Glucopyranose, 6-(dihydrogen phosphate)
데이터베이스 식별자
- CAS
15209-12-8- PubChem CID
- 439427
- DTXSID
DTXSID601344134- ChEMBL
CHEMBL257975- ChEBI
CHEBI:17719- UNII
- G6FRT62N3J
- Nikkaji
- J396.144C
물성
구조 계산 물성
- XLogP
- -4.2
- 극성 표면적
- 157 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 277
실험 및 물리화학적 성질
LogP-3.643
Physical DescriptionSolid
화학 및 산업
약리 정보
Metabolite PathwaysFanconi-bickel syndrome
관련 반응
21건
연결된 노트
불러오는 중…