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Details

Stereochemistry ACHIRAL
Molecular Formula C13H18N2O3
Molecular Weight 250.2936
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-CAFFEOYLPUTRESCINE

SMILES

NCCCCNC(=O)\C=C\C1=CC=C(O)C(O)=C1

InChI

InChIKey=KTZNZCYTXQYEHT-GQCTYLIASA-N
InChI=1S/C13H18N2O3/c14-7-1-2-8-15-13(18)6-4-10-3-5-11(16)12(17)9-10/h3-6,9,16-17H,1-2,7-8,14H2,(H,15,18)/b6-4+

HIDE SMILES / InChI

Molecular Formula C13H18N2O3
Molecular Weight 250.2936
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
ZE5I4Z92IW
Record Status Validated (UNII)
Record Version