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IMPPAT Phytochemical information:
(R)-(-)-(Z)-14-Methyl-8-hexadecen-1-ol
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY013108
Phytochemical name:
(R)-(-)-(Z)-14-Methyl-8-hexadecen-1-ol
Synonymous chemical names:
(r)-(-(z)-14-methyl-8-hexadecen-1-ol
External chemical identifiers:
CID:12487634
,
SureChEMBL:SCHEMBL7702597
Chemical structure information
SMILES:
OCCCCCCC/C=CCCCC[C@@H](CC)C
InChI:
InChI=1S/C17H34O/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18/h5,7,17-18H,3-4,6,8-16H2,1-2H3/b7-5-/t17-/m1/s1
InChIKey:
QRFJDYPDABYWFH-XTKXOIQPSA-N
DeepSMILES:
OCCCCCCC/C=CCCCC[C@@H]CC))C
Functional groups:
C/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:
1.401
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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