Station 4 of 13 · Molecule · the record
Agarospirol
Agarospirol, C15H26O, CAS 1460-73-7, is the sesquiterpene alcohol the house’s oud essay names as its key molecule. Its identity is PubChem’s.
A study of its biosynthesis calls it one of agarwood’s characteristic compounds, with a spicy, peppery, woody note; it was first isolated from the essential oil of Aquilaria malaccensis.
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
- agarospirol
documented
Agarospirol
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
confidence A
- CAS
- 1460-73-7
documented
1460-73-7
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
among the CID’s PubChem synonyms, and PubChem resolves it back to this CID
confidence A
- PubChem CID
- 21675005
documented
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
confidence A
- Formula
- C15H26O
documented
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
confidence A
- Molecular weight
- 222.37
documented
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
g/mol, as PubChem states it
confidence A
- IUPAC name
- 2-[(3R,5R,6R)-6,10-dimethylspiro[4.5]dec-9-en-3-yl]propan-2-ol
documented
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
confidence A
- SMILES
- C[C@@H]1CCC=C([C@@]12CC[C@H](C2)C(C)(C)O)C
documented
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
confidence A
- InChIKey
- ICWHTQRTTHCUHW-NFAWXSAZSA-N
documented
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
confidence A
- Odour threshold
- withheld: not on record
withheld
no odour-threshold measurement is filed: OT-1 has no entry and no open-access study was found (the house’s review, 2026-09-30)
- Descriptors
- spicy, peppery, woody
documented
Among these, agarospirol [17] is recognized as a characteristic aroma component [3,18], imparting a unique spicy, peppery, and woody note [19].
GC-14 · Wen S, Cheng W, Li Y, Er L, Wu M, Deng Z, Lu L, Liu T · read 2026-09-30
confidence B
- Volatility class
- not on record
not on record
the simulator’s data (modeled) has no entry for agarospirol
- Regulation
- not on record
not on record
no Regulation record yet
- 3D structure
- PubChem computed 3D conformer · 42 atoms, 43 bonds
modeled
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
PubChem’s computed 3D conformer (the 3D SDF record): a model, drawn schematically, not an experimental structure
confidence A
- Occurs in
- agarwood oil (oud oil)
documented · no share
first isolated from the essential oil of A. malaccensis (cited by GC-14)
confidence B
- agarwood oil (oud oil)
Claims register
Every sentence and number the site states about this record, with its status after the 2026-09-27 review.
- verified · CAS 1460-73-7
documented · register row 3
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
the CAS is among the PubChem synonyms of CID 21675005 and resolves back to it (the PubChem record filed with this entry)
where the site says it: /materials, “Aquilaria malaccensis”
confidence A
- verified · C₁₅H₂₆O
documented · register row 68
PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4 · read 2026-09-30
PubChem gives C15H26O for CID 21675005
where the site says it: /materials, “Aquilaria malaccensis”
confidence A
Sources
- PUBCHEM-21675005 · PubChem Compound Summary for CID 21675005, Agarospirol (2-[(3R,5R,6R)-6,10-dimethylspiro[4.5]dec-9-en-3-yl]propan-2-ol). National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine; live database, read 2026-09-30 through the PUG REST endpoints (no account): https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/name/1460-73-7/cids/JSON · https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/cid/21675005/property/MolecularFormula,MolecularWeight,IUPACName,Title,SMILES,InChIKey/JSON · https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/cid/21675005/synonyms/JSON · https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/cid/21675005/SDF?record_type=3d · https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/name/1460-73-7/cids/JSON. pubchem.ncbi.nlm.nih.gov/compound/21675005 · read 2026-09-30 · PubChem data are provided by NCBI (public-domain data; cite PubChem, the asset register molecules row); the computed conformer is PubChem-generated. The raw responses are filed as fetched (the house’s records).
- GC-14 · Wen S, Cheng W, Li Y, Er L, Wu M, Deng Z, Lu L, Liu T. Terpene synthases screening in agarwood tree Aquilaria yunnanensis leads to the discovery of agarospirol. Synthetic and Systems Biotechnology 2027;15:1–9 (online 17 June 2026). DOI 10.1016/j.synbio.2026.05.009. PMID 42376004. PMCID PMC13311179. doi.org/10.1016/j.synbio.2026.05.009 · read 2026-09-30 · CC BY-NC-ND 4.0 (open access, as the article states); short quotes only, nothing adapted or filed
These records are published under CC BY 4.0.
this record as data: /data/molecule/agarospirol.json · version 3 · updated 2026-09-30 · confidence A
