Kalihinol A

CAS Registry Number®

91294-83-6
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CAS Name

Kalihinol A

Molecular Formula

C22H33ClN2O2

Cite this Page

Kalihinol A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=91294-83-6 (retrieved 2024-09-21) (CAS RN: 91294-83-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    231-233 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H33ClN2O2/c1-19(2)16(23)10-13-22(5,27-19)15-8-11-20(3,25-7)14-9-12-21(4,26)18(24-6)17(14)15/h14-18,26H,8-13H2,1-5H3/t14-,15-,16-,17-,18+,20-,21+,22+/m0/s1

InChIKey

InChIKey=ULUHGZAAPMJKNO-QJUHQHJTSA-N

SMILES

C[C@@]1([C@@]2([C@@]3([C@@]([C@]([N+]#[C-])(C)CC2)(CC[C@@](C)(O)[C@@H]3[N+]#[C-])[H])[H])[H])OC(C)(C)[C@@H](Cl)CC1

Canonical SMILES

[C-]#[N+]C1C2C(CCC1(O)C)C([N+]#[C-])(C)CCC2C3(OC(C)(C)C(Cl)CC3)C

Other Names for this Substance

  • 2-Naphthalenol, 8-[(2R,5S)-5-chlorotetrahydro-2,6,6-trimethyl-2H-pyran-2-yl]decahydro-1,5-diisocyano-2,5-dimethyl-, (1R,2R,4aS,5S,8S,8aS)-
  • 2-Naphthalenol, 8-(5-chlorotetrahydro-2,6,6-trimethyl-2H-pyran-2-yl)decahydro-1,5-diisocyano-2,5-dimethyl-, [1α,2β,4aα,5α,8β(2R*,5R*),8aβ]-(+)-
  • (1R,2R,4aS,5S,8S,8aS)-8-[(2R,5S)-5-Chlorotetrahydro-2,6,6-trimethyl-2H-pyran-2-yl]decahydro-1,5-diisocyano-2,5-dimethyl-2-naphthalenol
  • (+)-Kalihinol A
  • Kalihinol A