Chem
J-GLOBAL ID:200907083239466691   Nikkaji number:J1.508.780C

3α-(Phosphonooxy)-4α-(3-O,4-O-diphosphono-α-D-xylopyranosyloxy)tetrahydrofuran

3α-(ホスホノオキシ)-4α-(3-O,4-O-ジホスホノ-α-D-キシロピラノシルオキシ)テトラヒドロフラン
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: C9H19O16P3
Molecular formula furigana: C9-H19-O16-P3
Molecular weight: 476.156
InChI: InChI=1S/C9H19O16P3/c10-7-8(25-28(17,18)19)6(24-27(14,15)16)3-21-9(7)22-4-1-20-2-5(4)23-26(11,12)13/h4-10H,1-3H2,(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)/t4-,5+,6-,7-,8+,9-/m1/s1
InChI key: LNNHGAKKYVKVBV-ZYWBIDCJSA-N
SMILES: O[C@H]1[C@@H](O[C@@H]2COC[C@@H]2OP(=O)(O)O)OC[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O
Systematic name  (3):
  • 3α-(ホスホノオキシ)-4α-(3-O,4-O-ジホスホノ-α-D-キシロピラノシルオキシ)テトラヒドロフラン
  • {[(3S,4R)-4-{[(2R,3R,4R,5R)-3-ヒドロキシ-4,5-ビス(ホスホノオキシ)オキサン-2-イル]オキシ}オキソラン-3-イル]オキシ}ホスホン酸
  • {[(3S,4R)-4-{[(2R,3R,4R,5R)-3-hydroxy-4,5-bis(phosphonooxy)oxan-2-yl]oxy}oxolan-3-yl]oxy}phosphonic acid
Other name (1):
  • 3α-(Phosphonooxy)-4α-(3-O,4-O-diphosphono-α-D-xylopyranosyloxy)tetrahydrofuran
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