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Details

Stereochemistry ACHIRAL
Molecular Formula C17H17NO5
Molecular Weight 315.3206
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-CAFFEOYLDOPAMINE

SMILES

OC1=CC=C(CCNC(=O)\C=C\C2=CC(O)=C(O)C=C2)C=C1O

InChI

InChIKey=FSMGGLPUXCKRGT-ZZXKWVIFSA-N
InChI=1S/C17H17NO5/c19-13-4-1-11(9-15(13)21)3-6-17(23)18-8-7-12-2-5-14(20)16(22)10-12/h1-6,9-10,19-22H,7-8H2,(H,18,23)/b6-3+

HIDE SMILES / InChI

Molecular Formula C17H17NO5
Molecular Weight 315.3206
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
HEM1G2VY70
Record Status Validated (UNII)
Record Version