Summary

IMPPAT Phytochemical identifier: IMPHY012682

Phytochemical name: N-Normethylskytanthine

Synonymous chemical names:
n-normethylskytanthine

External chemical identifiers:
CID:3082772

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Chemical structure information

SMILES:
C[C@@H]1CC[C@@H]2[C@H]1CNC[C@@H]2C

InChI:
InChI=1S/C10H19N/c1-7-3-4-9-8(2)5-11-6-10(7)9/h7-11H,3-6H2,1-2H3/t7-,8+,9+,10+/m1/s1

InChIKey:
XFDFLVUGOJZRPW-KATARQTJSA-N

DeepSMILES:
C[C@@H]CC[C@@H][C@H]5CNC[C@@H]6C

Functional groups:
CNC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CC2CCNCC2C1

Scaffold Graph/Node level:
C1CC2CCNCC2C1

Scaffold Graph level:
C1CCC2CCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Piperidines

NP Classifier Biosynthetic pathway: Alkaloids, Terpenoids

NP Classifier Superclass: Pseudoalkaloids

NP Classifier Class: Terpenoid alkaloids

NP-Likeness score: 1.25

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Chemical structure download