Summary

IMPPAT Phytochemical identifier: IMPHY004085

Phytochemical name: Drimaritin

Synonymous chemical names:
drymaritin

External chemical identifiers:
CID:3012902, ChEMBL:CHEMBL517641, ZINC:ZINC000014445185

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Chemical structure information

SMILES:
COc1cn2c3ccccc3c3c2c(c1=O)ncc3

InChI:
InChI=1S/C15H10N2O2/c1-19-12-8-17-11-5-3-2-4-9(11)10-6-7-16-13(14(10)17)15(12)18/h2-8H,1H3

InChIKey:
ARKHSSXCCQCKAF-UHFFFAOYSA-N

DeepSMILES:
COccncccccc6cc9cc%13=O))ncc6

Functional groups:
c=O, cOC, cn(c)c, cnc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1ccn2c3ccccc3c3ccnc1c32

Scaffold Graph/Node level:
OC1CCN2C3CCCCC3C3CCNC1C32

Scaffold Graph level:
CC1CCC2C3CCCCC3C3CCCC1C32

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Alkaloids and derivatives

ClassyFire Class: Indolonaphthyridine alkaloids

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Tryptophan alkaloids

NP Classifier Class: Carboline alkaloids

NP-Likeness score: 0.289

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Chemical structure download