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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H32O5
Molecular Weight 366.5218
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of DINOPROSTONE H-3

SMILES

[3H]\C(CCCC(O)=O)=C(/[3H])C[C@@]1([3H])C(=O)C[C@@]([3H])(O)[C@]1([3H])\C=C(/[3H])[C@@]([3H])(O)CCCCC

InChI

InChIKey=XEYBRNLFEZDVAW-VDWGORCHSA-N
InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,19+/m0/s1/i4T,7T,12T,15T,16T,17T,19T

HIDE SMILES / InChI

Molecular Formula C20H32O5
Molecular Weight 366.5218
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
S9HQU29PPR
Record Status Validated (UNII)
Record Version