Summary

IMPPAT Phytochemical identifier: IMPHY011795

Phytochemical name: 1,2,3,4,5-Cyclohexanepentol

Synonymous chemical names:
viburnitol

External chemical identifiers:
CID:101715, SureChEMBL:SCHEMBL1681800

---

Chemical structure information

SMILES:
OC1CC(O)C(C(C1O)O)O

InChI:
InChI=1S/C6H12O5/c7-2-1-3(8)5(10)6(11)4(2)9/h2-11H,1H2

InChIKey:
IMPKVMRTXBRHRB-UHFFFAOYSA-N

DeepSMILES:
OCCCO)CCC6O))O))O

Functional groups:
CO

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCCCC1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP Classifier Biosynthetic pathway: Carbohydrates

NP Classifier Superclass: Polyols

NP Classifier Class: Cyclitols

NP-Likeness score: 1.517

---

Chemical structure download