IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
O-Decylhydroxylamine
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY015873
Phytochemical name:
O-Decylhydroxylamine
Synonymous chemical names:
o-decyl hydroxylamine
External chemical identifiers:
CID:34704
,
ZINC:ZINC000002011426
,
SureChEMBL:SCHEMBL6725430
,
MolPort-025-494-294
Chemical structure information
SMILES:
CCCCCCCCCCON
InChI:
InChI=1S/C10H23NO/c1-2-3-4-5-6-7-8-9-10-12-11/h2-11H2,1H3
InChIKey:
MQNAOOIFODUDES-UHFFFAOYSA-N
DeepSMILES:
CCCCCCCCCCON
Functional groups:
CON
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Organic oxygen compounds
ClassyFire Class:
Organooxygen compounds
NP Classifier Biosynthetic pathway:
Fatty acids
NP-Likeness score:
0.395
Chemical structure download
2D:
2D MOL
2D MOL2
2D SDF
3D:
3D MOL
3D MOL2
3D SDF
3D PDB
3D PDBQT
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