Station 4 of 13 · Molecule · the record
Khusimol
Khusimol, C15H24O, is the sesquiterpene alcohol the house’s vetiver essay names as the oil’s principal molecule. Its identity is PubChem’s.
A review of vetiver counts it among the oil’s most concentrated alcohols and, in Haitian oil, among the molecules responsible for its odour. No share is given here.
Read the essay · The card · The material
The record
Each field carries its evidence: open a chip for the source, the quoted words and the confidence. A field with nothing behind it says so and stays empty.
- Name
- khusimol
documented
Khusimol
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
confidence A
- CAS
- 16223-63-5
documented
verified: the CAS is among the CID's PubChem synonyms
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
confidence A
- PubChem CID
- 167519
documented
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
confidence A
- Formula
- C15H24O
documented
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
confidence A
- Molecular weight
- 220.35
documented
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
g/mol, as PubChem states it
confidence A
- IUPAC name
- [(1R,2S,5S,8R)-7,7-dimethyl-6-methylidene-2-tricyclo[6.2.1.01,5]undecanyl]methanol
documented
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
confidence A
- SMILES
- CC1([C@@H]2CC[C@]3(C2)[C@H](CC[C@@H]3C1=C)CO)C
documented
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
confidence A
- InChIKey
- OOYRHNIVDZZGQV-BHPKHCPMSA-N
documented
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
confidence A
- Odour threshold
- withheld: not on record
withheld
no odour-threshold measurement is filed: OT-1 has no entry, and the vetiver study already on file (GC-11) gives thresholds for the zizaenones and khusimone, not khusimol (the house’s review, 2026-09-30)
- Descriptors
- not on record
not on record
no descriptor on record: no house wording on a data file, no descriptor source filed
- Volatility class
- not on record
not on record
the simulator’s data (modeled) has no entry for khusimol
- Regulation
- not on record
not on record
no Regulation record yet
- 3D structure
- PubChem computed 3D conformer · 40 atoms, 42 bonds
modeled
PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylide · read 2026-09-27
PubChem’s computed 3D conformer: a model, drawn schematically, not an experimental structure (the site’s molecule data note)
confidence A
- Occurs in
- vetiver oil (vetiver essential oil)
documented · no share
and in Haitian oil among the metabolites responsible for its odour (GC-10)
confidence B
- vetiver oil (vetiver essential oil)
Sources
- PUBCHEM-167519 · PubChem Compound Summary for CID 167519, Khusimol ([(1R,2S,5S,8R)-7,7-dimethyl-6-methylidene-2-tricyclo[6.2.1.01,5]undecanyl]methanol). National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine; live database, read 2026-09-27 through the PUG REST endpoints listed in the site’s molecule data. pubchem.ncbi.nlm.nih.gov/compound/167519 · read 2026-09-27 · PubChem data are provided by NCBI; the computed conformer is PubChem-generated. No file from PubChem is stored besides the derived JSON (PUBCHEM-108242, "Licence / reuse", written for CID 108242 and read as PubChem’s general terms; the terms for this CID were not re-read).
- GC-10 · Barcellos-Silva IGC, Dos Santos FKF, Kharkwal H, Chander S, Kharkwal AC, Awasthi R, Dhiman N, Sharma B, Kulkarni GT, Larssen H, Silva JML, Souza MA, Setzer WN, Veiga-Junior VF. Vetiver, Vetiveria zizanioides (L.) Nash: Biotechnology, Biorefineries, and the Production of Volatile Phytochemicals. Plants (Basel) 2025;14(10):1435. DOI 10.3390/plants14101435. PMID 40431000. PMCID PMC12114718. doi.org/10.3390/plants14101435 · read 2026-09-30 · CC BY 4.0 (open access, MDPI, as the article states); short quotes only, the text is not filed
These records are published under CC BY 4.0.
this record as data: /data/molecule/khusimol.json · version 2 · updated 2026-09-30 · confidence A
