Products 2948288-30-8

CAS 2948288-30-8 appears in our catalog under these names: Calcipotriol Impurity B, 98%, 98%, Impurity B of Calcipotriol, 98%. Offered by: Chemat, Fluorochem. Available pack sizes: 5mg, 10mg.

Structural formula: {0} (CAS {1})

Trans-(1R,3S,5Z)-5-[(2Z)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol (CAS 2948288-30-8) is a chemical compound with the molecular formula C27H40O3 and a molecular weight of 412.6 g/mol. IUPAC name: trans-(1R,3S,5Z)-5-[(2Z)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol. InChIKey: LWQQLNNNIPYSNX-CZCKTKQUSA-N.

Identity
Molecular formulaC27H40O3
Molecular weight412.6 g/mol
IUPAC nametrans-(1R,3S,5Z)-5-[(2Z)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
InChIKeyLWQQLNNNIPYSNX-CZCKTKQUSA-N
SMILESC[C@H](/C=C/[C@H](C1CC1)O)[C@H]2CC[C@@H]\3[C@@]2(CCC/C3=C/C=C\4/C[C@H](C[C@@H](C4=C)O)O)C

Computed by PubChem (NCBI)