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Molecule record

(6aR,10aR)-1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one

C24H36O3

372.55 g/mol

Loading structure

Molecular properties

Formula
C24H36O3
Molar mass
372.55 g·mol−1
Exact mass
372.2664 Da
7
PubChem CID
5284592

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ether
Ketone
Phenol

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • (-)-Nabilone
  • (6AR,10AR)-1-HYDROXY-6,6-DIMETHYL-3-(2-METHYLOCTAN-2-YL)-6H,6AH,7H,8H,9H,10H,10AH-BENZO[C]ISOCHROMEN-9-ONE
  • (6aR,10aR)-1-Hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-6,6a,7,8,10,10a-hexahydro-9H-dibenzo[b,d]pyran-9-one
  • 1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-7,8,10,10a-tetrahydro-6aH-benzo(c)chromen-9-one
  • 2N4O9L084N
  • 51022-71-0
  • 9H-Dibenzo(b,d)pyran-9-one, 3-(1,1-dimethylheptyl)-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-, (6aR,10aR)-rel-
  • A04AD11
Show all 24 synonyms
  • CPD 109514
  • Cesamet
  • Cesamet (TN)
  • DTXCID501473954
  • DTXSID8023341
  • LY 109514
  • NABILONE [USAN]
  • Nabilona
  • Nabilona [Spanish]
  • Nabilone
  • Nabilone (1.0 mg/mL in Acetonitrile)
  • Nabilone [USAN:INN:BAN]
  • Nabilonum
  • Nabilonum [Latin]
  • RefChem:56613
  • UNII-2N4O9L084N

Structure identifiers

Canonical SMILES
CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(=O)C[C@@H]21
Isomeric SMILES
CCCCCCC(C)(C)C1=CC(=C2[C@@H]3CC(=O)CC[C@H]3C(OC2=C1)(C)C)O
InChI
InChI=1S/C24H36O3/c1-6-7-8-9-12-23(2,3)16-13-20(26)22-18-15-17(25)10-11-19(18)24(4,5)27-21(22)14-16/h13-14,18-19,26H,6-12,15H2,1-5H3/t18-,19-/m1/s1
InChIKey
GECBBEABIDMGGL-RTBURBONSA-N
PubChem CID
5284592

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for (6aR,10aR)-1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for (6aR,10aR)-1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record
(6aR,10aR)-1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-7,8,10,10a-tet… - Formula, Structure | ChemArche