Chem
J-GLOBAL ID：200907058298223137
Nikkaji number：J932.105E
[[(4R,10aS)-4α-(Carbamoyloxymethyl)-10,10-dihydroxy-3aα,4,9,10-tetrahydro-1H,8H-pyrrolo[1,2-c]purine]-2,6(3H,5H)-diylidene]diiminium
(3aS,4R,10aS)-4-[(カルバモイルオキシ)メチル]-10,10-ジヒドロキシ-デカヒドロピロロ[1,2-c]プリン-2,6-ビス(イミニウム)
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
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
Molecular formula： C10H19N5[N+]2O4
Molecular formula furigana： C10-H19-N7-O4
Molecular weight： 301.306
InChI：
InChI=1S/C10H17N7O4/c11-6-15-5-4(3-21-8(13)18)14-7(12)17-2-1-9(19,20)10(5,17)16-6/h4-5,19-20H,1-3H2,(H2,12,14)(H2,13,18)(H3,11,15,16)/p+2/t4-,5-,10-/m0/s1
InChI key：
RPQXVSUAYFXFJA-HGRQIUPRSA-P
SMILES：
NC(=O)OC[C@@H]1NC(=[NH2+])N2CCC(O)(O)[C@]32NC(=[NH2+])N[C@@H]13
Systematic name (3)：
- [[(4R,10aS)-4α-(カルバモイルオキシメチル)-10,10-ジヒドロキシ-3aα,4,9,10-テトラヒドロ-1H,8H-ピロロ[1,2-c]プリン]-2,6(3H,5H)-ジイリデン]ジイミニウム
- (3aS,4R,10aS)-4-[(カルバモイルオキシ)メチル]-10,10-ジヒドロキシ-デカヒドロピロロ[1,2-c]プリン-2,6-ビス(イミニウム)
- (3aS,4R,10aS)-4-[(carbamoyloxy)methyl]-10,10-dihydroxy-decahydropyrrolo[1,2-c]purine-2,6-bis(iminium)
- [[(4R,10aS)-4α-(Carbamoyloxymethyl)-10,10-dihydroxy-3aα,4,9,10-tetrahydro-1H,8H-pyrrolo[1,2-c]purine]-2,6(3H,5H)-diylidene]diiminium
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