Chem
J-GLOBAL ID:200907019323533817   Nikkaji number:J1.317.663I

2,4,7β-Trihydroxy-8α-(hydroxymethyl)-8-methyl-1,3,5-trioxa-2,4-diphosphacyclooctane 2,4-dioxide

2,4,7β-トリヒドロキシ-8α-(ヒドロキシメチル)-8-メチル-1,3,5-トリオキサ-2,4-ジホスファシクロオクタン2,4-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: C5H12O7[O-]2[P+]2
Molecular formula furigana: C5-H12-O9-P2
Molecular weight: 278.090
InChI: InChI=1S/C5H12O9P2/c1-5(3-6)4(7)2-12-15(8,9)14-16(10,11)13-5/h4,6-7H,2-3H2,1H3,(H,8,9)(H,10,11)/t4-,5+/m1/s1
InChI key: SFRQRNJMIIUYDI-UHNVWZDZSA-N
SMILES: C[C@@]1(CO)O[P+](O)([O-])O[P+](O)([O-])OC[C@H]1O
Systematic name  (4):
  • (7R)-2,4,7β-トリヒドロキシ-8α-(ヒドロキシメチル)-8-メチル-1,3,5-トリオキサ-2,4-ジホスファシクロオクタン2,4-ジオキシド
  • 2,4,7β-トリヒドロキシ-8α-(ヒドロキシメチル)-8-メチル-1,3,5-トリオキサ-2,4-ジホスファシクロオクタン2,4-ジオキシド
  • (7R,8S)-2,4,7-トリヒドロキシ-8-(ヒドロキシメチル)-8-メチル-1,3,5,2,4-トリオキサジホスホカン-2,4-ジイウム-2,4-ビス(オラート)
  • (7R,8S)-2,4,7-trihydroxy-8-(hydroxymethyl)-8-methyl-1,3,5,2,4-trioxadiphosphocane-2,4-diium-2,4-bis(olate)
Other name (2):
  • (7R)-2,4,7β-Trihydroxy-8α-(hydroxymethyl)-8-methyl-1,3,5-trioxa-2,4-diphosphacyclooctane 2,4-dioxide
  • 2,4,7β-Trihydroxy-8α-(hydroxymethyl)-8-methyl-1,3,5-trioxa-2,4-diphosphacyclooctane 2,4-dioxide
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