IMPPAT Phytochemical information: 
Bornyl formate

Bornyl formate
Summary

IMPPAT Phytochemical identifier: IMPHY009763

Phytochemical name: Bornyl formate

Synonymous chemical names:
bornyl formate

External chemical identifiers:
CID:518472, SureChEMBL:SCHEMBL309630
Chemical structure information

SMILES:
O=COC1CC2C(C1(C)CC2)(C)C

InChI:
InChI=1S/C11H18O2/c1-10(2)8-4-5-11(10,3)9(6-8)13-7-12/h7-9H,4-6H2,1-3H3

InChIKey:
RDWUNORUTVEHJF-UHFFFAOYSA-N

DeepSMILES:
O=COCCCCC5C)CC5)))C)C

Functional groups:
COC=O
Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CC2CCC1C2

Scaffold Graph/Node level:
C1CC2CCC1C2

Scaffold Graph level:
C1CC2CCC1C2
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: Camphane monoterpenoids

NP-Likeness score: 2.346


Chemical structure download