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Details

Stereochemistry ACHIRAL
Molecular Formula C18H18O5S
Molecular Weight 346.398
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Magnolol sulfate

SMILES

OC1=CC=C(CC=C)C=C1C2=CC(CC=C)=CC=C2OS(O)(=O)=O

InChI

InChIKey=JJMBOAVHZRTJJO-UHFFFAOYSA-N
InChI=1S/C18H18O5S/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)23-24(20,21)22/h3-4,7-12,19H,1-2,5-6H2,(H,20,21,22)

HIDE SMILES / InChI

Molecular Formula C18H18O5S
Molecular Weight 346.398
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:55:30 GMT 2023
Edited
by admin
on Sat Dec 16 19:55:30 GMT 2023
Record UNII
Z748NEY9VL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Magnolol sulfate
Common Name English
[2'-hydroxy-5,5'-bis(prop-2-en-1-yl)-[1,1'-biphenyl]-2-yl]oxidanesulfonic acid
Systematic Name English
[1,1′-Biphenyl]-2,2′-diol, 5,5′-di-2-propen-1-yl-, 2-(hydrogen sulfate)
Systematic Name English
Code System Code Type Description
CAS
2454237-27-3
Created by admin on Sat Dec 16 19:55:31 GMT 2023 , Edited by admin on Sat Dec 16 19:55:31 GMT 2023
PRIMARY
FDA UNII
Z748NEY9VL
Created by admin on Sat Dec 16 19:55:31 GMT 2023 , Edited by admin on Sat Dec 16 19:55:31 GMT 2023
PRIMARY
PUBCHEM
145981796
Created by admin on Sat Dec 16 19:55:31 GMT 2023 , Edited by admin on Sat Dec 16 19:55:31 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE