Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID002168

Phytochemical name: trans-p-Mentha-2,8-dienol

Synonymous chemical names:
trans-p-Mentha-2,8-dienol, trans-p-mentha-2,8-dienol

External chemical identifiers:
CID:CID_91753981

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Chemical structure information

SMILES:
C[C@H]1CC[C@@H](C(=C1)O)C(=C)C

InChI:
InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6,8-9,11H,1,4-5H2,2-3H3/t8-,9+/m0/s1

InChIKey:
FXVHTIGBZHVHOB-DTWKUNHWSA-N

DeepSMILES:
C[C@H]CC[C@@H]C=C6)O))C=C)C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCCCC1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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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: Menthane monoterpenoids

NP-Likeness score: 2.203

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Chemical structure download