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기본 정보
- CAS
153322-50-0- 표준 SMILES
CC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@H]3N=C(N(C)C)O[C@H]3[C@@H]2CO)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O- InChIKey
MDWNFWDBQGOKNZ-SUAWCTRXSA-N- 분자식
- C25H42N4O14
- 평균 분자량
- 622.625 g/mol
- 단동위원소 질량
- 622.26975202
이름 및 식별자
- 우선 이름
- 2-(Dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl 2-deoxy-4-O-{2-deoxy-2-[(1-hydroxyethylidene)amino]hexopyranosyl}-2-[(1-hydroxyethylidene)amino]hexopyranoside
- IUPAC
- (3aR,4R,5R,6S,6aS)-2-(Dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl 2-deoxy-4-O-{2-deoxy-2-[(1-hydroxyethylidene)amino]-beta-D-glucopyranosyl}-2-[(1-hydroxyethylidene)amino]-beta-D-glucopyranoside
- 현지명
- N,N'-디아세틸키토비오실알로사미졸린
- 영어명
- N,N'-diacetylchitobiosyl allosamizoline
- 분자식
- C25H42N4O14
- 분자량
- 622.63
이름 및 동의어
N,N'-디아세틸키토비오실알로사미졸린N,N'-diacetylchitobiosyl allosamizolineβ-D-Glucopyranoside, (3aR,4R,5R,6S,6aS)-2-(dimethylamino)-3a,5,6,6a-tetrahydro-4-hydroxy-6-(hydroxymethyl)-4H-cyclopentoxazol-5-yl 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]-2-deoxy-N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-[[(3aR,4R,5R,6S,6aS)-2-(dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl]oxy]-5-acetamido-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
데이터베이스 식별자
- CAS
153322-50-0- PubChem CID
- 192630
- DTXSID
DTXSID80934733- Nikkaji
- J568.014J
물성
물리화학적 성질
- 밀도
- 1.78 · 1.78±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 12.76 · 12.76±0.70(Predicted)
화학 및 산업
공급사1 곳
BOC Sciences16314854226 · [email protected]
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