Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID014046

Phytochemical name: Isolongifolan-8-ol

Synonymous chemical names:
isolongifolan-8-ol, Isolongifolan-8-ol

External chemical identifiers:
CID:CID_535389

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Chemical structure information

SMILES:
OC1CCC(C23C1C(C)(C)C(C3)CC2)(C)C

InChI:
InChI=1S/C15H26O/c1-13(2)7-6-11(16)12-14(3,4)10-5-8-15(12,13)9-10/h10-12,16H,5-9H2,1-4H3

InChIKey:
VJCRIDPUJYUCNH-UHFFFAOYSA-N

DeepSMILES:
OCCCCCC6CC)C)CC5)CC6))))))C)C

Functional groups:
CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCC23CCC(CC2C1)C3

Scaffold Graph/Node level:
C1CCC23CCC(CC2C1)C3

Scaffold Graph level:
C1CCC23CCC(CC2C1)C3

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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: Sesquiterpenoids

NP-Likeness score: 3.032

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Chemical structure download