Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018101

Phytochemical name: Alpha-longipinen-7beta-ol

Synonymous chemical names:
alpha-Longipinen-7beta-ol

Chemical structure information

SMILES:
CC1=CCC2C3C1C2(C)CC[C@@H](C3(C)C)O

InChI:
InChI=1S/C15H24O/c1-9-5-6-10-13-12(9)15(10,4)8-7-11(16)14(13,2)3/h5,10-13,16H,6-8H2,1-4H3/t10?,11-,12?,13?,15?/m0/s1

InChIKey:
KTJNTCLZIKICCL-LDJXKFRGSA-N

DeepSMILES:
CC=CCCCC6C4C)CC[C@@H]C7C)C))O

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CC2C3CCCCC2C3C1

Scaffold Graph/Node level:
C1CCC2C3CCCC2C3C1

Scaffold Graph level:
C1CCC2C3CCCC2C3C1

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Chemical classification

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Longipinane sesquiterpenoids

NP-Likeness score: 3.231

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Chemical structure download