Summary

IMPPAT Phytochemical identifier: IMPHY002328

Phytochemical name: Acetyldihydrolycopodine

Synonymous chemical names:
acetyldihydrolycopodine

Chemical structure information

SMILES:
C[C@@H]1C[C@H]2C[C@H]([C@@H]3[C@@]4(C1)[C@@H]2CCCN4CCC3)OC(=O)C

InChI:
InChI=1S/C18H29NO2/c1-12-9-14-10-17(21-13(2)20)16-6-4-8-19-7-3-5-15(14)18(16,19)11-12/h12,14-17H,3-11H2,1-2H3/t12-,14+,15-,16-,17-,18-/m1/s1

InChIKey:
SZELUKCBWALJTL-PCCLBNHKSA-N

DeepSMILES:
C[C@@H]C[C@H]C[C@H][C@@H][C@@]C8)[C@@H]6CCCN6CCC%10))))))))))OC=O)C

Functional groups:
CC(=O)OC, CN(C)C

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CC2CCC3CCCC24C3CCCN4C1

Scaffold Graph/Node level:
C1CC2CCC3CCCC24C3CCCN4C1

Scaffold Graph level:
C1CC2CCCC3C4CCCC23C(C1)CC4

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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: Alkaloids

NP Classifier Superclass: Lysine alkaloids

NP Classifier Class: Quinolizidine alkaloids

NP-Likeness score: 2.035

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Chemical structure download