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Details

Stereochemistry EPIMERIC
Molecular Formula C20H32O4
Molecular Weight 336.4657
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 3
Charge 0
Stereo Comments Assuemed 9E, stereochemistry from 129171-42-2

SHOW SMILES / InChI
Structure of HEPOXILIN A3

SMILES

CCCCC\C=C/C[C@@H]1O[C@H]1\C=C\C(O)C\C=C/CCCC(O)=O

InChI

InChIKey=SGTUOBURCVMACZ-SEVPPISGSA-N
InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18-19(24-18)16-15-17(21)12-9-7-8-11-14-20(22)23/h6-7,9-10,15-19,21H,2-5,8,11-14H2,1H3,(H,22,23)/b9-7-,10-6-,16-15+/t17?,18-,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H32O4
Molecular Weight 336.4657
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 3
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
BSO00N6UES
Record Status Validated (UNII)
Record Version