Structure via PubChem · Public domain (PubChem)
In the Vinony graph
Within Vinony's link graph, CP 47,497 is referenced by 507 other articles, and connects out to cannabinoids, tetrahydrocannabinol and synthetic cannabinoid.
It sits within the topics Alkyl-substituted benzenes, Cannabinoids and CB1 receptor agonists.
Its subject is documented across 10 Wikipedia language editions.
Chemical data
- Formula
- C21H34O2
- Molecular weight
- 318.5 g/mol
- IUPAC name
- 2-[(1R,3S)-3-hydroxycyclohexyl]-5-(2-methyloctan-2-yl)phenol
- SMILES
- CCCCCCC(C)(C)C1=CC(=C(C=C1)[C@@H]2CCC[C@@H](C2)O)O
- InChIKey
- ZWWRREXSUJTKNN-AEFFLSMTSA-N
- XLogP
- 6.7
- Polar surface area
- 40.5 Ų
- H-bond donors
- 2
- H-bond acceptors
- 2
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Has part
- carbon
- Mass
- 318.25588032799993
Show 4 more facts
- canonical SMILES
- CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)O)O
- chemical formula
- C₂₁H₃₄O₂
- Commons category
- CP-47,497
- isomeric SMILES
- CCCCCCC(C)(C)c1ccc([C@@H]2CCC[C@H](O)C2)c(O)c1
Sources (2)
via Wikidata · CC0
Connections
cannabinoids
Entity
tetrahydrocannabinol
Entity
synthetic cannabinoid
Entity
nonbenzodiazepine
Entity
JWH-210
Entity
synhexyl
Entity
International Standard Book Number
Entity
xenon
Entity
digital object identifier
Entity
chemical formula
Entity
heroin
Entity
morphine
Entity
Amanita muscaria
Entity
nutmeg
Entity
Rhododendron
Entity
lysergic acid diethylamide
Entity
Pfizer
Entity
analgesic
Entity
molar mass
Entity
(RS)-ketamine
Entity
Categories
Alkyl-substituted benzenesCannabinoidsCB1 receptor agonistsChemical articles with multiple PubChem CIDsChemical pages without DrugBank identifierChemicals using indexlabelsCyclohexanolsDesigner drugsDrugs developed by PfizerDrugs missing an ATC codeDrugs with non-standard legal statusMultiple chemicals in Infobox drugPhenols