기본 정보
- 표준 SMILES
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O- InChIKey
KFEUJDWYNGMDBV-UHFFFAOYSA-N- 분자식
- C14H25NO11
- 평균 분자량
- 383.35 g/mol
- 단동위원소 질량
- 383.14276061
이름 및 식별자
- 우선 이름
- 2-Acetamido-2-deoxy-4-O-hexopyranosylhexopyranose
- IUPAC
- N-[2,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
이름 및 동의어
DTXSID708656232-Acetamido-2-deoxy-4-O-hexopyranosylhexopyranoseRefChem:935394GlyTouCan:G86325GUDTXCID70814015G86325GU82535-18-0Man-?-1,4-GlcNAcSCHEMBL13211438N-[(3R,4R,5R,6R)-2,4-DIHYDROXY-6-(HYDROXYMETHYL)-5-{[(2S,3R,4S,5R,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}OXAN-3-YL]ACETAMIDEN-[(3R,4R,5S,6R)-2,4-DIHYDROXY-6-(HYDROXYMETHYL)-5-{[(2S,3S,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}OXAN-3-YL]ACETAMIDEN-[(3S,4R,5S,6R)-2,4-DIHYDROXY-6-(HYDROXYMETHYL)-5-{[(2S,3R,4S,5R,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}OXAN-3-YL]ACETAMIDE
이름 더 보기
AKOS015919228AB02556AB66238OA06652LS-14349N-[2,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamidePD041778CS-0456020
데이터베이스 식별자
- PubChem CID
- 245
- DTXSID
DTXSID70865623
물성
구조 계산 물성
- XLogP
- -4.7
- 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
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