Summary

IMPPAT Phytochemical identifier: IMPHY015618

Phytochemical name: Dihydromyrcenol

Synonymous chemical names:
dihydro-myrcenol, dihydromyrcenol

External chemical identifiers:
CID:29096, ChEMBL:CHEMBL3184487, ChEBI:87528, FDASRS:46L1B02ND9, SureChEMBL:SCHEMBL29192, MolPort-001-792-059

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Chemical structure information

SMILES:
C=CC(CCCC(O)(C)C)C

InChI:
InChI=1S/C10H20O/c1-5-9(2)7-6-8-10(3,4)11/h5,9,11H,1,6-8H2,2-4H3

InChIKey:
XSNQECSCDATQEL-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCO)C)C)))))C

Functional groups:
C=CC, CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids

NP-Likeness score: 2.054

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Chemical structure download