Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID006845

Phytochemical name: Nerolol

Synonymous chemical names:
nerolol

External chemical identifiers:
CID:CID_18632430, SureChEMBL:SCHEMBL11586065

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Chemical structure information

SMILES:
CC(=CCC/C(=C\C(O)O)/C)C

InChI:
InChI=1S/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7,10-12H,4,6H2,1-3H3/b9-7-

InChIKey:
GUFDVXNIWHWGBS-CLFYSBASSA-N

DeepSMILES:
CC=CCC/C=C\CO)O)))/C)))))C

Functional groups:
CC=C(C)C, C/C(C)=C\C(O)O

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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: Acyclic monoterpenoids

NP-Likeness score: 2.409

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Chemical structure download