(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-Octahydro-7a-methyl-1-[(1R,3S)-6,6,6-trifluoro-3,5-dihydroxy-1-methyl-5-(trifluoromethyl)hexyl]-3H-inden-3-ylidene]ethylidene]-4-methylene-1,3-cyclohexanediol

CAS Registry Number®

114489-80-4

CAS Name

(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-Octahydro-7a-methyl-1-[(1R,3S)-6,6,6-trifluoro-3,5-dihydroxy-1-methyl-5-(trifluoromethyl)hexyl]-3H-inden-3-ylidene]ethylidene]-4-methylene-1,3-cyclohexanediol

Molecular Formula

C27H38F6O4

Molecular Mass

540.58

Cite this Page

(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-Octahydro-7a-methyl-1-[(1R,3S)-6,6,6-trifluoro-3,5-dihydroxy-1-methyl-5-(trifluoromethyl)hexyl]-3H-inden-3-ylidene]ethylidene]-4-methylene-1,3-cyclohexanediol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=114489-80-4 (retrieved 2024-11-22) (CAS RN: 114489-80-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H38F6O4/c1-15(11-20(35)14-25(37,26(28,29)30)27(31,32)33)21-8-9-22-17(5-4-10-24(21,22)3)6-7-18-12-19(34)13-23(36)16(18)2/h6-7,15,19-23,34-37H,2,4-5,8-14H2,1,3H3/b17-6+,18-7-/t15-,19-,20+,21-,22+,23+,24-/m1/s1

InChIKey

InChIKey=SVMOCCGIPIDIDM-JXGVRYCNSA-N

SMILES

C[C@@]12[C@](\C(=C\C=C\3/C(=C)[C@@H](O)C[C@H](O)C3)\CCC1)(CC[C@@]2([C@@H](C[C@@H](CC(C(F)(F)F)(C(F)(F)F)O)O)C)[H])[H]

Canonical SMILES

FC(F)(F)C(O)(CC(O)CC(C)C1CCC2C(=CC=C3C(=C)C(O)CC(O)C3)CCCC21C)C(F)(F)F

Other Names for this Substance

  • 1,3-Cyclohexanediol, 5-[(2E)-2-[(1R,3aS,7aR)-octahydro-7a-methyl-1-[(1R,3S)-6,6,6-trifluoro-3,5-dihydroxy-1-methyl-5-(trifluoromethyl)hexyl]-3H-inden-3-ylidene]ethylidene]-4-methylene-, (1R,3S,5Z)-
  • 9,10-Secocholesta-5,7,10(19)-triene-1,3,23,25-tetrol, 26,26,26,27,27,27-hexafluoro-, (1α,3β,5Z,7E,23S)-
  • (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-Octahydro-7a-methyl-1-[(1R,3S)-6,6,6-trifluoro-3,5-dihydroxy-1-methyl-5-(trifluoromethyl)hexyl]-3H-inden-3-ylidene]ethylidene]-4-methylene-1,3-cyclohexanediol
  • ST 232
  • SM 10193

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