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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28O2
Molecular Weight 312.4458
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of GUGGULSTERONE, (Z)-

SMILES

[H][C@@]12CC(=O)\C(=C/C)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C

InChI

InChIKey=WDXRGPWQVHZTQJ-OSJVMJFVSA-N
InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18+,20+,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H28O2
Molecular Weight 312.4458
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:46:25 UTC 2023
Edited
by admin
on Sat Dec 16 01:46:25 UTC 2023
Record UNII
6CST3U34GN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GUGGULSTERONE, (Z)-
Common Name English
4,17(20)-CIS-PREGNADIENE-3,6-DIONE
Common Name English
CIS-GUGGULSTERONE
Common Name English
Z-GUGGULSTERONE
Common Name English
PREGNA-4,17(20)-DIENE-3,16-DIONE, (17Z)-
Systematic Name English
GUGGULSTERONE Z-FORM
MI  
Common Name English
(17Z)-GUGGULSTERONE
Common Name English
GUGGULSTERONE Z (CONSTITUENT OF GUGGUL) [DSC]
Common Name English
GUGGULSTERONE Z-FORM [MI]
Common Name English
GUGGULSTERONE Z
USP-RS  
Common Name English
GUGGULSTERONE Z [USP-RS]
Common Name English
Classification Tree Code System Code
DSLD 2405 (Number of products:11)
Created by admin on Sat Dec 16 01:46:25 UTC 2023 , Edited by admin on Sat Dec 16 01:46:25 UTC 2023
Code System Code Type Description
CAS
39025-23-5
Created by admin on Sat Dec 16 01:46:25 UTC 2023 , Edited by admin on Sat Dec 16 01:46:25 UTC 2023
PRIMARY
FDA UNII
6CST3U34GN
Created by admin on Sat Dec 16 01:46:25 UTC 2023 , Edited by admin on Sat Dec 16 01:46:25 UTC 2023
PRIMARY
RS_ITEM_NUM
1302214
Created by admin on Sat Dec 16 01:46:25 UTC 2023 , Edited by admin on Sat Dec 16 01:46:25 UTC 2023
PRIMARY
PUBCHEM
6450278
Created by admin on Sat Dec 16 01:46:25 UTC 2023 , Edited by admin on Sat Dec 16 01:46:25 UTC 2023
PRIMARY
MERCK INDEX
m5878
Created by admin on Sat Dec 16 01:46:25 UTC 2023 , Edited by admin on Sat Dec 16 01:46:25 UTC 2023
PRIMARY Merck Index
EPA CompTox
DTXSID1033539
Created by admin on Sat Dec 16 01:46:25 UTC 2023 , Edited by admin on Sat Dec 16 01:46:25 UTC 2023
PRIMARY