Summary

IMPPAT Phytochemical identifier: IMPHY011686

Phytochemical name: (+)-Borneol

Synonymous chemical names:
(+)-borneol, (+)borneol, borneol (+), d-borneol

External chemical identifiers:
CID:6552009, ChEMBL:CHEMBL486208, ChEBI:15393, ZINC:ZINC000000968100, FDASRS:M89NIB437X, SureChEMBL:SCHEMBL56713, MolPort-003-926-877

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Chemical structure information

SMILES:
O[C@H]1C[C@@H]2C([C@@]1(C)CC2)(C)C

InChI:
InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8+,10+/m1/s1

InChIKey:
DTGKSKDOIYIVQL-WEDXCCLWSA-N

DeepSMILES:
O[C@H]C[C@@H]C[C@@]5C)CC5)))C)C

Functional groups:
CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CC2CCC1C2

Scaffold Graph/Node level:
C1CC2CCC1C2

Scaffold Graph level:
C1CC2CCC1C2

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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: 2.542

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Chemical structure download