Summary

IMPPAT Phytochemical identifier: IMPHY003221

Phytochemical name: Norglaucin

Synonymous chemical names:
norglaucine

External chemical identifiers:
CID:30835, ZINC:ZINC000005733035

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Chemical structure information

SMILES:
COc1cc2-c3c4[C@H](Cc2cc1OC)NCCc4cc(c3OC)OC

InChI:
InChI=1S/C20H23NO4/c1-22-15-9-12-7-14-18-11(5-6-21-14)8-17(24-3)20(25-4)19(18)13(12)10-16(15)23-2/h8-10,14,21H,5-7H2,1-4H3/t14-/m0/s1

InChIKey:
MZSUVQFIWWXTFR-AWEZNQCLSA-N

DeepSMILES:
COccc-cc[C@H]Cc6cc%10OC))))))NCCc6ccc%10OC)))OC

Functional groups:
CNC, cOC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c(c1)CC1NCCc3cccc-2c31

Scaffold Graph/Node level:
C1CCC2C(C1)CC1NCCC3CCCC2C31

Scaffold Graph level:
C1CCC2C(C1)CC1CCCC3CCCC2C31

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Alkaloids and derivatives

ClassyFire Class: Aporphines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Tyrosine alkaloids

NP Classifier Class: Aporphine alkaloids, Isoquinoline alkaloids

NP-Likeness score: 1.388

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Chemical structure download