| Identification | Back Directory | [Name]
(1R,3aR,7aR)-1-((2R,5S,E)-6-hydroxy-5,6-diMethylhept-3-en-2-yl)-7a-Methylhexahydro-1H-inden-4(2H)-one | [CAS]
95716-68-0 | [Synonyms]
PRC-2
Paricalcitol-1
Paricalcitol Impurity 4
Paricalcitol Impurity 3
Paricalcitol Intermediate-16
Paricalcitol Impurity 4 (PRC-2)
<1R<1β(R*,E,S),3aα,7aβ>>-6-(Octahydro-7a-methyl-1H-4-oxoinden-1-yl)-2,3-dimethyl-4-hepten-2-ol
(1R,3aR,7aR)-1-((2R,5S,E)-6-hydroxy-5,6-dimethylhept
-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-one
(1R,3ar,7ar)-1-((2r,5s,e)-6-Hydroxy-5,6-dimethylhept-3-en-2-yl)-7a-methylhexahydro-1h-inden-4(2h)-on
(1R,3aR,7aR)-1-((2R,5S,E)-6-hydroxy-5,6-diMethylhept-3-en-2-yl)-7a-Methylhexahydro-1H-inden-4(2H)-one
(1R,3aR,7aR)-Octahydro-1-[(1R,2E,4S)-5-hydroxy-1,4,5-trimethyl-2-hexen-1-yl]-7a-methyl-4H-inden-4-one
1R-(1α(1R*,2E,4S*),3aβ,7aα)-octahydro-1-(5-hydroxy-1,4,5-triMethyl-2-hexen-yl)-7a-Methyl-4H-inden-4-one
4H-Inden-4-one, octahydro-1-[(1R,2E,4S)-5-hydroxy-1,4,5-triMethyl-2-hexen-1-yl]-7a-Methyl-, (1R,3aR,7aR)-
[1R-[1alpha,(1R*,2E,4S*),3abeta,7aalpha]]-Octahydro-1-(5-hydroxy-1,4,5-trimethyl-2-hexenyl)-7a-methyl-4H-inden-4-one
Paricalcitol impurity 1/(1R,3aR,7aR)-1-((2R,5S,E)-6-hydroxy-5,6-diMethylhept-3-en-2-yl)-7a-Methylhexahydro-1H-inden-4(2H)-one | [Molecular Formula]
C19H32O2 | [MDL Number]
MFCD22573292 | [MOL File]
95716-68-0.mol | [Molecular Weight]
292.46 |
| Chemical Properties | Back Directory | [Boiling point ]
400.4±18.0 °C(Predicted) | [density ]
0.992±0.06 g/cm3(Predicted) | [pka]
14.93±0.29(Predicted) | [InChI]
InChI=1S/C19H32O2/c1-13(8-9-14(2)18(3,4)21)15-10-11-16-17(20)7-6-12-19(15,16)5/h8-9,13-16,21H,6-7,10-12H2,1-5H3/b9-8+/t13-,14+,15-,16+,19-/m1/s1 | [InChIKey]
QZJWXZGUOIMBAV-WXWTUHQWSA-N | [SMILES]
[C@@H]1([C@H](C)/C=C/[C@H](C)C(O)(C)C)[C@]2(C)[C@]([H])(C(=O)CCC2)CC1 |
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