rel-(2R,3aR,4R,6aS,7aR,8aS,9S,12R,12aS,13aS,13bR,13cR)-Eicosahydro-2,6a,12-trimethyl-4,9-bis(1-methylethyl)-1H-benzo[de]naphthacene

CAS Registry Number®

130466-40-9
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CAS Name

rel-(2R,3aR,4R,6aS,7aR,8aS,9S,12R,12aS,13aS,13bR,13cR)-Eicosahydro-2,6a,12-trimethyl-4,9-bis(1-methylethyl)-1H-benzo[de]naphthacene

Molecular Formula

C30H52

Molecular Mass

412.73

Cite this Page

rel-(2R,3aR,4R,6aS,7aR,8aS,9S,12R,12aS,13aS,13bR,13cR)-Eicosahydro-2,6a,12-trimethyl-4,9-bis(1-methylethyl)-1H-benzo[de]naphthacene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=130466-40-9 (retrieved 2024-09-09) (CAS RN: 130466-40-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C30H52/c1-17(2)22-9-8-20(6)24-15-25-21(14-26(22)24)16-30(7)11-10-23(18(3)4)27-12-19(5)13-28(25)29(27)30/h17-29H,8-16H2,1-7H3/t19-,20-,21-,22+,23-,24+,25+,26+,27-,28-,29-,30+/s2

InChIKey

InChIKey=PTJNNBKAZKHNHT-JINZNAKHNA-N

SMILES

C[C@]12[C@@]3([C@]([C@]4([C@](C1)(C[C@]5([C@](C4)([C@@H](C)CC[C@@H]5C(C)C)[H])[H])[H])[H])(C[C@@H](C)C[C@]3([C@H]([C@@H](C)C)CC2)[H])[H])[H]

Canonical SMILES

CC(C)C1CCC(C)C2CC3C(CC12)CC4(C)CCC(C(C)C)C5CC(C)CC3C54

Other Names for this Substance

  • 1H-Benzo[de]naphthacene, eicosahydro-2,6a,12-trimethyl-4,9-bis(1-methylethyl)-, (2R,3aR,4R,6aS,7aR,8aS,9S,12R,12aS,13aS,13bR,13cR)-rel-
  • 1H-Benzo[de]naphthacene, eicosahydro-2,6a,12-trimethyl-4,9-bis(1-methylethyl)-, (2α,3aβ,4β,6aα,7aα,8aα,9α,12β,12aβ,13aβ,13bα,13cα)-
  • rel-(2R,3aR,4R,6aS,7aR,8aS,9S,12R,12aS,13aS,13bR,13cR)-Eicosahydro-2,6a,12-trimethyl-4,9-bis(1-methylethyl)-1H-benzo[de]naphthacene
  • cis-cis-trans-Bicadinane