Chemical Compound

({[({[(3'aR,4'R,6'R,6'aR)-4'-(6-amino-9H-purin-9-yl)-2,4,6-trinitro-3'a,4',6',6'a-tetrahydrospiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxole]-2,5-dien-6'-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid

CAS Registry Number 120360-48-7
({[({[(3'aR,4'R,6'R,6'aR)-4'-(6-amino-9H-purin-9-yl)-2,4,6-trinitro-3'a,4',6',6'a-tetrahydrospiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxole]-2,5-dien-6'-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid 结构式
Primary record

({[({[(3'aR,4'R,6'R,6'aR)-4'-(6-amino-9H-purin-9-yl)-2,4,6-trinitro-3'a,4',6',6'a-tetrahydrospiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxole]-2,5-dien-6'-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid

库存
6,204 克
纯度
99.2 %
CAS
120360-48-7

化合物标识与属性

CAS
120360-48-7
PubChem CID
11542191
SMILES
C1=C(C2(C(=CC1[N+](=O)[O-])[N+](=O)[O-])O[C@@H]3[C@H](O[C@H]([C@@H]3O2)N4C=NC5=C(N=CN=C54)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[N+](=O)[O-]
Canonical SMILES
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]2OC3(O[C@H]21)C([N+](=O)[O-])=CC([N+](=O)[O-])C=C3[N+](=O)[O-]

名称与同义词

  • Tnp-ATP
  • TNP-ATP (sodium salt)
  • CHEMBL337395
  • BDBM50540410
  • CID11542191
  • CID 11542191
  • J676.877F
  • 2 -O,3 -O-(2,4,6-Trinitro-2,5-cyclohexadien-1-ylidene)adenosine 5 -triphosphate
  • ({[({[(3'aR,4'R,6'R,6'aR)-4'-(6-amino-9H-purin-9-yl)-2,4,6-trinitro-3'a,4',6',6'a-tetrahydrospiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxole]-2,5-dien-6'-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
  • 120360-48-7
  • 2',3'-O-(2,4,6-Trinitro-2,5-cyclohexadien-1-ylidene)adenosine 5'-(tetrahydrogen triphosphate)