올리고만노스-3-Fuc(1-6)(Man-3-Fuc)
N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-2,4-dihydroxy-6-oxo-1-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-3-yl]oxy-5-[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
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기본 정보
- CAS
110387-51-4- 표준 SMILES
CC(=O)N[C@H]1[C@H](O[C@@H]([C@H](O)[C@H](C=O)NC(C)=O)[C@H](O)CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@@H]1O- InChIKey
AVNPKRIXOZKGDS-DYXCVAHDSA-N- 분자식
- C40H68N2O30
- 평균 분자량
- 1,057 g/mol
- 단동위원소 질량
- 1,056.38568876
이름 및 식별자
- 우선 이름
- N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-2,4-dihydroxy-6-oxo-1-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-3-yl]oxy-5-[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
- IUPAC
- N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-2,4-dihydroxy-6-oxo-1-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-3-yl]oxy-5-[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
- 현지명
- 올리고만노스-3-Fuc(1-6)(Man-3-Fuc)
- 영어명
- Oligomannose-3-Fuc (1-6) (Man-3-Fuc)
- 분자식
- C40H68N2O30
- 분자량
- 1056.96
이름 및 동의어
올리고만노스-3-Fuc(1-6)(Man-3-Fuc)Man-3-FOligomannose-3-Fuc (1-6) (Man-3-Fuc)Pentasaccharide core (1-6) fucosylated(MAN-3F)Manalpha1-6(Manalpha1-3)Manbeta1-4GlcNAcbeta1-4(Fucalpha1-6)GlcNAcD-Glucose, O-α-D-mannopyranosyl-(1→3)-O-[α-D-mannopyranosyl-(1→6)]-O-β-D-mannopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→4)-O-[6-deoxy-α-L-galactopyranosyl-(1→6)]-2-(acetylamino)-2-deoxy-O-6-Deoxy-alpha-L-galactopyranosyl-(1-6)-O-[O-alpha-D-mannopyranosyl-(1-3)-O-[alpha-D-mannopyranosyl-(1-6)]-O-beta-D-mannopyranosyl-(1-4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)]-2-(acetylamino)-2-deoxy-D-glucose
데이터베이스 식별자
- CAS
110387-51-4- PubChem CID
- 131865807
물성
구조 계산 물성보충 중
- XLogP
- -12
- 극성 표면적
- 511 Ų
- 수소 결합 공여자 수
- 19
- 수소 결합 수용자 수
- 30
- 회전 가능 결합 수
- 21
- 무거운 원자 수
- 72
- 형식 전하
- 0
- 복잡도
- 1,710
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