Summary

IMPPAT Phytochemical identifier: IMPHY007275

Phytochemical name: 1,6-Germacradien-5-ol

Synonymous chemical names:
1,6-germacradien-5-ol

External chemical identifiers:
CID:91748908

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Chemical structure information

SMILES:
C/C/1=C/CC(C(C)C)C(/C=C(CCC1)/C)O

InChI:
InChI=1S/C15H26O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h8,10-11,14-16H,5-7,9H2,1-4H3/b12-8-,13-10-

InChIKey:
JZGKKDAVPHTIQS-KDVDBFTISA-N

DeepSMILES:
C/C=C/CCCC)C))C/C=CCCC%10)))/C)))O

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCCCC=CCCC1

Scaffold Graph/Node level:
C1CCCCCCCCC1

Scaffold Graph level:
C1CCCCCCCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Sesquiterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Germacrane sesquiterpenoids

NP-Likeness score: 2.227

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Chemical structure download