Summary

IMPPAT Phytochemical identifier: IMPHY009703

Phytochemical name: Silfiperfol-6-ene

Synonymous chemical names:
silphiperfol-6-ene

External chemical identifiers:
CID:10867444, ZINC:ZINC000146133093

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Chemical structure information

SMILES:
C[C@@H]1CC[C@@]23[C@H]1CC[C@@]3(C)CC(=C2C)C

InChI:
InChI=1S/C15H24/c1-10-5-8-15-12(3)11(2)9-14(15,4)7-6-13(10)15/h10,13H,5-9H2,1-4H3/t10-,13+,14+,15+/m1/s1

InChIKey:
VIXZYZFZHINXMQ-KJEVXHAQSA-N

DeepSMILES:
C[C@@H]CC[C@][C@H]5CC[C@@]5C)CC=C8C))C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CC23CCCC2CCC3C1

Scaffold Graph/Node level:
C1CC2CCC3CCCC23C1

Scaffold Graph level:
C1CC2CCC3CCCC23C1

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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: Silphiperfolane sesquiterpenoids

NP-Likeness score: 2.229

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Chemical structure download