Summary

IMPPAT Phytochemical identifier: IMPHY017166

Phytochemical name: 9-Methylfluorene

Synonymous chemical names:
9-methyl-fluorene

External chemical identifiers:
CID:17299, ZINC:ZINC000001459890, FDASRS:95M10BKB07, SureChEMBL:SCHEMBL40599, MolPort-001-759-756

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Chemical structure information

SMILES:
CC1c2ccccc2-c2c1cccc2

InChI:
InChI=1S/C14H12/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14/h2-10H,1H3

InChIKey:
ZVEJRZRAUYJYCO-UHFFFAOYSA-N

DeepSMILES:
CCcccccc6-cc9cccc6

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c(c1)Cc1ccccc1-2

Scaffold Graph/Node level:
C1CCC2C(C1)CC1CCCCC12

Scaffold Graph level:
C1CCC2C(C1)CC1CCCCC12

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Benzenoids

ClassyFire Class: Fluorenes

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids

NP-Likeness score: 0.065

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Chemical structure download