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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16O4
Molecular Weight 272.2958
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VESTITOL, (-)-

SMILES

COC1=CC(O)=C(C=C1)[C@@H]2COC3=C(C2)C=CC(O)=C3

InChI

InChIKey=XRVFNNUXNVWYTI-NSHDSACASA-N
InChI=1S/C16H16O4/c1-19-13-4-5-14(15(18)8-13)11-6-10-2-3-12(17)7-16(10)20-9-11/h2-5,7-8,11,17-18H,6,9H2,1H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16O4
Molecular Weight 272.2958
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 09:48:36 UTC 2023
Edited
by admin
on Sat Dec 16 09:48:36 UTC 2023
Record UNII
9JHS2AVR43
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VESTITOL, (-)-
Common Name English
(-)-VESTITOL
Common Name English
2H-1-BENZOPYRAN-7-OL, 3,4-DIHYDRO-3-(2-HYDROXY-4-METHOXYPHENYL)-, (3R)-
Systematic Name English
(3R)-VESTITOL
Common Name English
(R)-(-)-VESTITOL
Common Name English
Code System Code Type Description
FDA UNII
9JHS2AVR43
Created by admin on Sat Dec 16 09:48:36 UTC 2023 , Edited by admin on Sat Dec 16 09:48:36 UTC 2023
PRIMARY
PUBCHEM
182259
Created by admin on Sat Dec 16 09:48:36 UTC 2023 , Edited by admin on Sat Dec 16 09:48:36 UTC 2023
PRIMARY
CAS
35878-41-2
Created by admin on Sat Dec 16 09:48:36 UTC 2023 , Edited by admin on Sat Dec 16 09:48:36 UTC 2023
PRIMARY
CHEBI
16786
Created by admin on Sat Dec 16 09:48:36 UTC 2023 , Edited by admin on Sat Dec 16 09:48:36 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
PARENT -> CONSTITUENT ALWAYS PRESENT
(3R)-VESTITOL was tested for antimicrobial activity against methicillin sensitive Staphylococcus aureus, methicillin resistant S. aureus, Micrococcus luteus, Bacillus subtilis, Escherichia coli, Klebsiella pneumoniae and Pseudomonas aeruginosa and found to be inactive.