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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H22O4
Molecular Weight 338.397
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4'-O-METHYLGLABRIDIN, (S)-

SMILES

COC1=CC(O)=C(C=C1)[C@H]2COC3=C4C=CC(C)(C)OC4=CC=C3C2

InChI

InChIKey=ZZAIPFIGEGQNHP-CQSZACIVSA-N
InChI=1S/C21H22O4/c1-21(2)9-8-17-19(25-21)7-4-13-10-14(12-24-20(13)17)16-6-5-15(23-3)11-18(16)22/h4-9,11,14,22H,10,12H2,1-3H3/t14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H22O4
Molecular Weight 338.397
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:53:26 GMT 2023
Edited
by admin
on Sat Dec 16 18:53:26 GMT 2023
Record UNII
42T76VX3Y5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4'-O-METHYLGLABRIDIN, (S)-
Common Name English
2-(8,8-DIMETHYL-3,4-DIHYDRO-2H,8H-PYRANO(2,3-F)CHROMEN-3-YL)-5-METHOXYPHENOL, (S)-
Systematic Name English
(S)-2-(8,8-DIMETHYL-3,4-DIHYDRO-2H,8H-PYRANO(2,3-F)CHROMEN-3-YL)-5-METHOXYPHENOL
Systematic Name English
PHENOL, 2-(3,4-DIHYDRO-8,8-DIMETHYL-2H,8H-BENZO(1,2-B:3,4-B')DIPYRAN-3-YL)-5-METHOXY-, (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
42T76VX3Y5
Created by admin on Sat Dec 16 18:53:26 GMT 2023 , Edited by admin on Sat Dec 16 18:53:26 GMT 2023
PRIMARY
CAS
105119-61-7
Created by admin on Sat Dec 16 18:53:26 GMT 2023 , Edited by admin on Sat Dec 16 18:53:26 GMT 2023
PRIMARY
PUBCHEM
21676179
Created by admin on Sat Dec 16 18:53:26 GMT 2023 , Edited by admin on Sat Dec 16 18:53:26 GMT 2023
PRIMARY
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