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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H27ClO2
Molecular Weight 310.859
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.ALPHA.-CHLORO-17.BETA.-HYDROXYESTR-4-EN-3-ONE

SMILES

[H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CC[C@H](O)C=C4[C@H](Cl)C[C@@]23[H]

InChI

InChIKey=YFUYYNGQROLCKT-HHHJPISDSA-N
InChI=1S/C18H27ClO2/c1-18-7-6-12-11-3-2-10(20)8-14(11)16(19)9-13(12)15(18)4-5-17(18)21/h8,10-13,15-17,20-21H,2-7,9H2,1H3/t10-,11+,12+,13+,15-,16+,17-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H27ClO2
Molecular Weight 310.859
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:12:25 GMT 2023
Edited
by admin
on Sat Dec 16 10:12:25 GMT 2023
Record UNII
70Q1QG2TLK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6.ALPHA.-CHLORO-17.BETA.-HYDROXYESTR-4-EN-3-ONE
Systematic Name English
ESTR-4-EN-3-ONE, 6.ALPHA.-CHLORO-17.BETA.-HYDROXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
112500390
Created by admin on Sat Dec 16 10:12:25 GMT 2023 , Edited by admin on Sat Dec 16 10:12:25 GMT 2023
PRIMARY
CAS
2984-14-7
Created by admin on Sat Dec 16 10:12:25 GMT 2023 , Edited by admin on Sat Dec 16 10:12:25 GMT 2023
PRIMARY
FDA UNII
70Q1QG2TLK
Created by admin on Sat Dec 16 10:12:25 GMT 2023 , Edited by admin on Sat Dec 16 10:12:25 GMT 2023
PRIMARY