Summary

IMPPAT Phytochemical identifier: IMPHY009729

Phytochemical name: Verbenene

Synonymous chemical names:
verbenene, verbenene*

External chemical identifiers:
CID:6427476

---

Chemical structure information

SMILES:
C=C1C=CC2CC1C2(C)C

InChI:
InChI=1S/C10H14/c1-7-4-5-8-6-9(7)10(8,2)3/h4-5,8-9H,1,6H2,2-3H3

InChIKey:
YOQFOABVDRBYCG-UHFFFAOYSA-N

DeepSMILES:
C=CC=CCCC6C4C)C

Functional groups:
C=C(C)C=CC

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1C=CC2CC1C2

Scaffold Graph/Node level:
CC1CCC2CC1C2

Scaffold Graph level:
CC1CCC2CC1C2

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Monoterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Monoterpenoids

NP Classifier Class: Carane monoterpenoids

NP-Likeness score: 3.189

---

Chemical structure download