Chem
J-GLOBAL ID:200907024897242946   Nikkaji number:J1.794.159C

8-[(2S,3S,4R)-2,3,4,5-Tetrahydroxypentyl]-6-[3-(phosphonooxy)propyl]pteridine-2,4,7(1H,3H,8H)-trione

8-[(2S,3S,4R)-2,3,4,5-テトラヒドロキシペンチル]-6-[3-(ホスホノオキシ)プロピル]プテリジン-2,4,7(1H,3H,8H)-トリオン
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: C14H21N4O11P
Molecular formula furigana: C14-H21-N4-O11-P
Molecular weight: 452.313
InChI: InChI=1S/C14H21N4O11P/c19-5-8(21)10(22)7(20)4-18-11-9(12(23)17-14(25)16-11)15-6(13(18)24)2-1-3-29-30(26,27)28/h7-8,10,19-22H,1-5H2,(H2,26,27,28)(H2,16,17,23,25)/t7-,8+,10-/m0/s1
InChI key: URBYNSQKZFYCOM-XKSSXDPKSA-N
SMILES: OC[C@@H](O)[C@@H](O)[C@@H](O)Cn1c2[nH]c(=O)[nH]c(=O)c2nc(CCCOP(=O)(O)O)c1=O
Systematic name  (3):
  • 8-[(2S,3S,4R)-2,3,4,5-テトラヒドロキシペンチル]-6-[3-(ホスホノオキシ)プロピル]プテリジン-2,4,7(1H,3H,8H)-トリオン
  • (3-{2,4,7-トリオキソ-8-[(2S,3S,4R)-2,3,4,5-テトラヒドロキシペンチル]-1,2,3,4,7,8-ヘキサヒドロプテリジン-6-イル}プロポキシ)ホスホン酸
  • (3-{2,4,7-trioxo-8-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-1,2,3,4,7,8-hexahydropteridin-6-yl}propoxy)phosphonic acid
Other name (1):
  • 8-[(2S,3S,4R)-2,3,4,5-Tetrahydroxypentyl]-6-[3-(phosphonooxy)propyl]pteridine-2,4,7(1H,3H,8H)-trione
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