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Huagongshe 오픈 프로젝트:[email protected]AI 접속: llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.7.8
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(2R,3R,4S,5S,6R)-2-((2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-((2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl)oxyoxan-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol

HCID 178964809
노트반응
기본 정보개요이름 및 식별자물성관련 반응화합물 노트
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기본 정보

표준 SMILES
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
InChIKey
FYGDTMLNYKFZSV-WUZXSGHDSA-N
분자식
C18H32O16
평균 분자량
504.4 g/mol
단동위원소 질량
504.16903494

개요

Alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-beta-D-Glcp is a glucotriose consisting of two alpha-D-glucose residues and a beta-D-glucose at the reducing end joined in sequence by (14) glycosidic linkages. It is a glucotriose and a D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-beta-D-Glcp.

이름 및 식별자

우선 이름
(2R,3R,4S,5S,6R)-2-((2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-((2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl)oxyoxan-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol
IUPAC
(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

이름 및 동의어

(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol(2R,3R,4S,5S,6R)-2-((2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-((2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl)oxyoxan-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triolRefChem:934723GlyTouCan:G00395FSG00395FS2ggu3ckbSCHEMBL3725665Glc(a1-4)Glc(a1-4)b-GlcCHEBI:1460544-O-[4-O-(alpha-D-Glucopyranosyl)-alpha-D-glucopyranosyl]-beta-D-glucopyranosealpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-beta-D-Glcp
이름 더 보기
Alpha-D-Glucopyranosyl-(1->4)-Alpha-D-Glucopyranosyl-(1->4)-Beta-D-GlucopyranoseWURCS=2.0/2,3,2/[a2122h-1b_1-5][a2122h-1a_1-5]/1-2-2/a4-b1_b4-c1alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranose

데이터베이스 식별자

ChEBI
CHEBI:146054
Nikkaji
J3.065.938D

물성

구조 계산 물성

XLogP
-6.9
극성 표면적
269 Ų
수소 결합 공여자 수
11
수소 결합 수용자 수
16
회전 가능 결합 수
7
무거운 원자 수
34
형식 전하
0
복잡도
641

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