D-glucopyranose 1-phosphate

HCID 439165

기본 정보

표준 SMILES
O=P(O)(O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIKey
HXXFSFRBOHSIMQ-GASJEMHNSA-N
분자식
C6H13O9P
평균 분자량
260.14 g/mol

개요

D-glucopyranose 1-phosphate is a D-glucose monophosphate in which the phosphate group is located at position 1. It has a role as a fundamental metabolite. It is functionally related to a D-glucose and a D-glucopyranose. It is a conjugate acid of a D-glucopyranose 1-phosphate(2-).

이름 및 식별자

우선 이름
D-glucopyranose 1-phosphate
IUPAC
[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate

이름 및 동의어

D-glucopyranose 1-phosphateGLC-1-P1-O-phosphono-D-glucopyranoseCHEBI:16077D-glucopyranose 1-(dihydrogen phosphate)RefChem:130590glucose 1-phosphate[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphatea-D-Galactose 1-phosphateglucopyranose 1-phosphateSCHEMBL104855{[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phosphonic acid
이름 더 보기
Q27098367(3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl dihydrogen phosphate

데이터베이스 식별자

PubChem CID
439165
ChEBI
CHEBI:16077
Nikkaji
J375.972E

물성

구조 계산 물성

XLogP
-3.8
극성 표면적
157 Ų
수소 결합 공여자 수
6
수소 결합 수용자 수
9
회전 가능 결합 수
3
무거운 원자 수
16

실험 및 물리화학적 성질

Collision Cross Section · 2건

158.3 Ų [M+Na]+ [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

157.5 Ų [M+Na]+ [CCS Type: DT; Method: single field calibrated with Agilent tune mix (Agilent)]

관련 반응

6건

연결된 노트

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