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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H35N2O2
Molecular Weight 311.4827
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 2
Charge 1

SHOW SMILES / InChI
Structure of Complanine, (-)-

SMILES

CC\C=C/C\C=C/CC[C@@H](O)CNC(=O)CCC[N+](C)(C)C

InChI

InChIKey=QYFDYRHORFAECH-SVCKQPKZSA-O
InChI=1S/C18H34N2O2/c1-5-6-7-8-9-10-11-13-17(21)16-19-18(22)14-12-15-20(2,3)4/h6-7,9-10,17,21H,5,8,11-16H2,1-4H3/p+1/b7-6-,10-9-/t17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H35N2O2
Molecular Weight 311.4827
Charge 1
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
BXC744Y6CF
Record Status Validated (UNII)
Record Version