IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
10-Undecen-1-OL
Summary
Physicochemical
Drug-likeness
ADME
Descriptors
Patents
Summary
IMPPAT Phytochemical identifier:
IMPPAT3_PHYID012150
Phytochemical name:
10-Undecen-1-OL
Synonymous chemical names:
10-undecenol
External chemical identifiers:
CID:CID_8185
,
ChEBI:CHEBI:131344
,
ZINC:ZINC000001693210
,
FDASRS:G63HL09NXK
,
SureChEMBL:SCHEMBL41157
,
MolPort-001-760-000
Chemical structure information
SMILES:
OCCCCCCCCCC=C
InChI:
InChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h2,12H,1,3-11H2
InChIKey:
GIEMHYCMBGELGY-UHFFFAOYSA-N
DeepSMILES:
OCCCCCCCCCC=C
Functional groups:
CO, C=CC
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:
1.16
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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