기본 정보
- 표준 SMILES
CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O- InChIKey
HMQPEDMEOBLSQB-RPHKZZMBSA-N- 분자식
- C14H25NO11
- 평균 분자량
- 383.35 g/mol
개요
Beta-D-Galp-(1->3)-D-GlcpNAc is an amino disaccharide consisting of beta-D-galactose linked via a (13)-glycosidic bond to N-acetyl-D-glucosamine. It has a role as an epitope. It is an amino disaccharide and a glucosamine oligosaccharide.
이름 및 식별자
- 우선 이름
- Lacto-N-biose
- IUPAC
- N-[(3R,4R,5S,6R)-2,5-dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
이름 및 동의어
Lacto-N-biosebeta-D-Gal-(1->3)-D-GlcNAcbeta-D-Galactopyranosyl-(1->3)-N-acetyl-D-glucosamineRefChem:621115GlyTouCan:G04616STG04616STGalbeta1,3GlcNAc489-52-1beta-D-Galp-(1->3)-D-GlcpNAcGalbeta1-3GlcNAcMFCD00036714N-[(3R,4R,5S,6R)-2,5-dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
이름 더 보기
CHEMBL4862340CHEBI:277072-Acetamido-2-deoxy-3-O-(beta-D-galactopyranosyl)-D-glucopyranosebeta-D-galactsyl-(1->3)-N-acetyl-D-glucosamine2-Acetamido-2-deoxy-3-O-(b-D-galactopyranosyl)-D-galactose2-Acetamido-2-deoxy-3-O-(b-D-galactopyranosyl)-D-glucopyranosebeta-D-Galactosyl-(1-3)-N-acetylgalactosamine; Gal1-beta-3GalNAc; O-beta-D-Galactopyranosyl-(1-3)-N-acetylgalactosamine;N-[(3R,4R,5S,6R)-2,5-dihydroxy-6-(hydroxymethyl)-4-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl]acetamide
데이터베이스 식별자
- PubChem CID
- 440994
- ChEMBL
CHEMBL4862340- ChEBI
CHEBI:27707- Nikkaji
- J552.826G
물성
구조 계산 물성
- XLogP
- -4.2
- 극성 표면적
- 198 Ų
- 수소 결합 공여자 수
- 8
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 480
관련 반응
2건
연결된 노트
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