Summary

IMPPAT Phytochemical identifier: IMPHY017864

Phytochemical name: (E)-Longipinocarveol

Synonymous chemical names:
(e)-longipinocarveol

External chemical identifiers:
CID:91749849

---

Chemical structure information

SMILES:
C=C1C(O)CC2C3C1C2(C)CCCC3(C)C

InChI:
InChI=1S/C15H24O/c1-9-11(16)8-10-13-12(9)15(10,4)7-5-6-14(13,2)3/h10-13,16H,1,5-8H2,2-4H3

InChIKey:
WAOFYFVAVCDGBJ-UHFFFAOYSA-N

DeepSMILES:
C=CCO)CCCC6C4C)CCCC7C)C

Functional groups:
C=C(C)C, CO

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1CCC2C3CCCCC2C13

Scaffold Graph/Node level:
CC1CCC2C3CCCCC2C13

Scaffold Graph level:
CC1CCC2C3CCCCC2C13

---

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: Sesquiterpenoids

NP Classifier Class: Longipinane sesquiterpenoids

NP-Likeness score: 3.45

---

Chemical structure download