U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H14O5
Molecular Weight 262.258
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SMYRINDIOL

SMILES

CC(C)(O)[C@H]1OC2=CC3=C(C=CC(=O)O3)C=C2[C@H]1O

InChI

InChIKey=AIQSGHBQRRSBCN-OLZOCXBDSA-N
InChI=1S/C14H14O5/c1-14(2,17)13-12(16)8-5-7-3-4-11(15)18-9(7)6-10(8)19-13/h3-6,12-13,16-17H,1-2H3/t12-,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H14O5
Molecular Weight 262.258
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:04:53 GMT 2023
Edited
by admin
on Sat Dec 16 11:04:53 GMT 2023
Record UNII
75X957W22U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SMYRINDIOL
Common Name English
7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE, 2,3-DIHYDRO-3-HYDROXY-2-(1-HYDROXY-1-METHYLETHYL)-, (2S,3R)-
Systematic Name English
SMIRINDIOL
Common Name English
SMYRINDIOL, (+)-
Common Name English
(+)-3'-HYDROXYMARMESIN
Common Name English
7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE, 2,3-DIHYDRO-3-HYDROXY-2-(1-HYDROXY-1-METHYLETHYL)-, (2S-CIS)-
Systematic Name English
(2'S,3'R)-3'-HYDROXY MARMESIN
Common Name English
Code System Code Type Description
PUBCHEM
92261439
Created by admin on Sat Dec 16 11:04:53 GMT 2023 , Edited by admin on Sat Dec 16 11:04:53 GMT 2023
PRIMARY
FDA UNII
75X957W22U
Created by admin on Sat Dec 16 11:04:53 GMT 2023 , Edited by admin on Sat Dec 16 11:04:53 GMT 2023
PRIMARY
CAS
87725-60-8
Created by admin on Sat Dec 16 11:04:53 GMT 2023 , Edited by admin on Sat Dec 16 11:04:53 GMT 2023
PRIMARY