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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32O5S
Molecular Weight 432.573
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.BETA.-HYDROXY-SPIRONOLACTONE

SMILES

[H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])[C@H](SC(C)=O)[C@@H](O)C5=CC(=O)CC[C@]45C

InChI

InChIKey=CMDJXLWZYONFCD-YGIRGZTLSA-N
InChI=1S/C24H32O5S/c1-13(25)30-21-19-15(22(2)8-4-14(26)12-17(22)20(21)28)5-9-23(3)16(19)6-10-24(23)11-7-18(27)29-24/h12,15-16,19-21,28H,4-11H2,1-3H3/t15-,16-,19+,20-,21-,22+,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H32O5S
Molecular Weight 432.573
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:53:46 UTC 2023
Edited
by admin
on Sat Dec 16 10:53:46 UTC 2023
Record UNII
RH8L8AL2LR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6.BETA.-HYDROXY-SPIRONOLACTONE
Common Name English
S-((2R)-6.BETA.-HYDROXY-3,5-DIOXO-3,4-DIHYDRO-5H-SPIRO(ANDROST-4-ENE-17,2-FURAN)-7.ALPHA.-YL) ETHANETHIOATE
Systematic Name English
SPIRONOLACTONE IMPURITY G [EP IMPURITY]
Common Name English
PREGN-4-ENE-21-CARBOXYLIC ACID, 7-(ACETYLTHIO)-6,17-DIHYDROXY-3-OXO-, .GAMMA.-LACTONE, (6.BETA.,7.ALPHA.,17.ALPHA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
RH8L8AL2LR
Created by admin on Sat Dec 16 10:53:46 UTC 2023 , Edited by admin on Sat Dec 16 10:53:46 UTC 2023
PRIMARY
PUBCHEM
131886535
Created by admin on Sat Dec 16 10:53:46 UTC 2023 , Edited by admin on Sat Dec 16 10:53:46 UTC 2023
PRIMARY
CAS
880106-10-5
Created by admin on Sat Dec 16 10:53:46 UTC 2023 , Edited by admin on Sat Dec 16 10:53:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP