Summary

IMPPAT Phytochemical identifier: IMPHY014505

Phytochemical name: Silphiperfolan-6beta-ol

Synonymous chemical names:
silphiperfolan-6-β-ol

External chemical identifiers:
CID:91746522

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Chemical structure information

SMILES:
C[C@@H]1CC[C@@]23C1CC[C@@]3(C)C[C@]([C@H]2C)(C)O

InChI:
InChI=1S/C15H26O/c1-10-5-8-15-11(2)14(4,16)9-13(15,3)7-6-12(10)15/h10-12,16H,5-9H2,1-4H3/t10-,11-,12?,13+,14+,15+/m1/s1

InChIKey:
SNSNYEAITDGGIF-JNFIVRNDSA-N

DeepSMILES:
C[C@@H]CC[C@]C5CC[C@@]5C)C[C@][C@H]8C))C)O

Functional groups:
CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CC2CCC3CCCC23C1

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: 3.043

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Chemical structure download