Aprosulate

HCID 72126

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기본 정보

CAS: 123123-68-2
표준 SMILES: O=C(NCCCNC(=O)[C@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@H](O[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)[C@@H](COS(=O)(=O)O)OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@H](O[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)[C@@H](COS(=O)(=O)O)OS(=O)(=O)O
InChIKey: KSXQTGMWWMBCIP-VXMGFIRPSA-N
분자식: C27H50N2O70S16
평균 분자량: 2,035.713 g/mol
단동위원소 질량: 2,033.594559

우선 이름: Aprosulate
IUPAC: [(Propane-1,3-diyl)bis(azanediyl)-(2R,3R,4S,5R)-6-oxo-3-({(2S,3R,4S,5S,6R)-3,4,5-tris(sulfooxy)-6-[(sulfooxy)methyl]oxan-2-yl}oxy)hexane-6,1,2,4,5-pentayl] octakis(hydrogen sulfate)

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CAS: 123123-68-2
표준 SMILES: O=C(NCCCNC(=O)[C@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@H](O[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)[C@@H](COS(=O)(=O)O)OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@H](O[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)[C@@H](COS(=O)(=O)O)OS(=O)(=O)O
InChIKey: KSXQTGMWWMBCIP-VXMGFIRPSA-N
분자식: C27H50N2O70S16
평균 분자량: 2,035.713 g/mol
단동위원소 질량: 2,033.594559

우선 이름: Aprosulate
IUPAC: [(Propane-1,3-diyl)bis(azanediyl)-(2R,3R,4S,5R)-6-oxo-3-({(2S,3R,4S,5S,6R)-3,4,5-tris(sulfooxy)-6-[(sulfooxy)methyl]oxan-2-yl}oxy)hexane-6,1,2,4,5-pentayl] octakis(hydrogen sulfate)

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