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Details

Stereochemistry RACEMIC
Molecular Formula C18H24
Molecular Weight 240.3832
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Estra-1,3,5(10)-triene, (±)-

SMILES

C[C@@]12CCC[C@H]1[C@@H]3CCC4=CC=CC=C4[C@H]3CC2

InChI

InChIKey=HLCRYAZDZCJZFG-BDXSIMOUSA-N
InChI=1S/C18H24/c1-18-11-4-7-17(18)16-9-8-13-5-2-3-6-14(13)15(16)10-12-18/h2-3,5-6,15-17H,4,7-12H2,1H3/t15-,16-,17+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H24
Molecular Weight 240.3832
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 14:15:36 GMT 2025
Edited
by admin
on Wed Apr 02 14:15:36 GMT 2025
Record UNII
LS6ZMJ3JT2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Estra-1,3,5(10)-triene, (±)-
Preferred Name English
Code System Code Type Description
CAS
777087-72-6
Created by admin on Wed Apr 02 14:15:36 GMT 2025 , Edited by admin on Wed Apr 02 14:15:36 GMT 2025
PRIMARY
FDA UNII
LS6ZMJ3JT2
Created by admin on Wed Apr 02 14:15:36 GMT 2025 , Edited by admin on Wed Apr 02 14:15:36 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE