IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
11-Dodecen-1-ol
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY009095
Phytochemical name:
11-Dodecen-1-ol
Synonymous chemical names:
11-dodecenol
External chemical identifiers:
CID:520725
,
SureChEMBL:SCHEMBL128745
Chemical structure information
SMILES:
OCCCCCCCCCCC=C
InChI:
InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2,13H,1,3-12H2
InChIKey:
QNXYZQSFDTZEBK-UHFFFAOYSA-N
DeepSMILES:
OCCCCCCCCCCC=C
Functional groups:
C=CC, CO
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Lipids and lipid-like molecules
ClassyFire Class:
Fatty acyls
ClassyFire Subclass:
Fatty alcohols
NP Classifier Biosynthetic pathway:
Fatty acids
NP Classifier Superclass:
Fatty acyls
NP Classifier Class:
Fatty alcohols
NP-Likeness score:
1.071
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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