Chem
J-GLOBAL ID:200907027456837846   Nikkaji number:J1.358.775B

(2R)-2β-[(R)-1-Methyl-2-oxo-2-methoxyethyl]-6β-[(1R)-1-[(2R)-5β-[(2S)-2-hydroxypentyl]oxolane-2β-yl]ethyl]hexahydro-1,5-dioxa-4-thia-1H-indene 4,4-dioxide

(2R)-2β-[(R)-1-メチル-2-オキソ-2-メトキシエチル]-6β-[(1R)-1-[(2R)-5β-[(2S)-2-ヒドロキシペンチル]オキソラン-2β-イル]エチル]ヘキサヒドロ-1,5-ジオキサ-4-チア-1H-インデン4,4-ジオキシド
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C21H36O6[O-]2[S+2]
Molecular formula furigana: C21-H36-O8-S
Molecular weight: 448.570
InChI: InChI=1S/C21H36O8S/c1-5-6-14(22)9-15-7-8-16(27-15)12(2)18-10-19-20(30(24,25)29-18)11-17(28-19)13(3)21(23)26-4/h12-20,22H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17-,18-,19?,20?/m1/s1
InChI key: UCZRVHNMFFDBGU-ILYKQUJCSA-N
SMILES: CCC[C@H](O)C[C@@H]1CC[C@@H](O1)[C@@H](C)[C@H]1CC2O[C@H](CC2[S+2]([O-])([O-])O1)[C@@H](C)C(=O)OC
Systematic name  (3):
  • (2R)-2β-[(R)-1-メチル-2-オキソ-2-メトキシエチル]-6β-[(1R)-1-[(2R)-5β-[(2S)-2-ヒドロキシペンチル]オキソラン-2β-イル]エチル]ヘキサヒドロ-1,5-ジオキサ-4-チア-1H-インデン4,4-ジオキシド
  • (3R,6R)-3-[(1R)-1-[(2R,5S)-5-[(2S)-2-ヒドロキシペンチル]オキソラン-2-イル]エチル]-6-[(2R)-1-メトキシ-1-オキソプロパン-2-イル]-ヘキサヒドロ-1H-フロ[3,2-c][1,2]オキサチイン-1,1-ジイウム-1,1-ビス(オラート)
  • (3R,6R)-3-[(1R)-1-[(2R,5S)-5-[(2S)-2-hydroxypentyl]oxolan-2-yl]ethyl]-6-[(2R)-1-methoxy-1-oxopropan-2-yl]-hexahydro-1H-furo[3,2-c][1,2]oxathiine-1,1-diium-1,1-bis(olate)
Other name (1):
  • (2R)-2β-[(R)-1-Methyl-2-oxo-2-methoxyethyl]-6β-[(1R)-1-[(2R)-5β-[(2S)-2-hydroxypentyl]oxolane-2β-yl]ethyl]hexahydro-1,5-dioxa-4-thia-1H-indene 4,4-dioxide
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