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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H32O6
Molecular Weight 368.4645
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 11-DEHYDROTHROMBOXANE B2

SMILES

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

InChI

InChIKey=KJYIVXDPWBUJBQ-UHHGALCXSA-N
InChI=1S/C20H32O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h4,7,12-13,15-18,21-22H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/b7-4-,13-12+/t15-,16-,17-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H32O6
Molecular Weight 368.4645
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
CJ6ST9UG7C
Record Status Validated (UNII)
Record Version