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Details

Stereochemistry ACHIRAL
Molecular Formula C27H28N2O3
Molecular Weight 428.5228
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADIPORON

SMILES

O=C(COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2)NC3CCN(CC4=CC=CC=C4)CC3

InChI

InChIKey=SHHUPGSHGSNPDB-UHFFFAOYSA-N
InChI=1S/C27H28N2O3/c30-26(28-24-15-17-29(18-16-24)19-21-7-3-1-4-8-21)20-32-25-13-11-23(12-14-25)27(31)22-9-5-2-6-10-22/h1-14,24H,15-20H2,(H,28,30)

HIDE SMILES / InChI

Molecular Formula C27H28N2O3
Molecular Weight 428.5228
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
ND7UVH6GKJ
Record Status Validated (UNII)
Record Version