Chemical Compound

(1R,3S,5Z)-5-[(2E)-2-[(1S,3Ar,7aS)-1-[(2S)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

CAS Registry Number 32222-06-3
(1R,3S,5Z)-5-[(2E)-2-[(1S,3Ar,7aS)-1-[(2S)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol 结构式
Primary record

(1R,3S,5Z)-5-[(2E)-2-[(1S,3Ar,7aS)-1-[(2S)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

库存
3,124 克
纯度
99.0 %
CAS
32222-06-3

化合物标识与属性

CAS
32222-06-3
PubChem CID
10093379
SMILES
C[C@@H](CCCC(C)(C)O)[C@@H]1CC[C@H]\2[C@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C
Canonical SMILES
C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]2CC[C@H]3[C@@H](C)CCCC(C)(C)O)C[C@@H](O)C[C@@H]1O

名称与同义词

  • calcitriol
  • CHEMBL159112
  • ZINC3994235
  • CID10093379
  • J1.464.472E
  • 32222-06-3
  • (13S,14R,17S,20S)-1alpha,25-Dihydroxycholecalciferol
  • (1R,3S,5Z)-5-[(2E)-2-[(1S,3Ar,7aS)-1-[(2S)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
  • (1R,3S,5Z)-5-{2-[(1S,3aR,4E,7aS)-1-[(2S)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol