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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H14O4
Molecular Weight 258.2693
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEMETHYLVESTITOL, (S)-

SMILES

OC1=CC(O)=C(C=C1)[C@H]2COC3=CC(O)=CC=C3C2

InChI

InChIKey=CJZBXHPHEBCWLV-SNVBAGLBSA-N
InChI=1S/C15H14O4/c16-11-3-4-13(14(18)6-11)10-5-9-1-2-12(17)7-15(9)19-8-10/h1-4,6-7,10,16-18H,5,8H2/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H14O4
Molecular Weight 258.2693
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 12:05:30 GMT 2023
Edited
by admin
on Sat Dec 16 12:05:30 GMT 2023
Record UNII
0M77LRT61C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEMETHYLVESTITOL, (S)-
Common Name English
DEMETHYLVESTITOL, (+)-
Common Name English
1,3-BENZENEDIOL, 4-(3,4-DIHYDRO-7-HYDROXY-2H-1-BENZOPYRAN-3-YL)-, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
119026218
Created by admin on Sat Dec 16 12:05:30 GMT 2023 , Edited by admin on Sat Dec 16 12:05:30 GMT 2023
PRIMARY
FDA UNII
0M77LRT61C
Created by admin on Sat Dec 16 12:05:30 GMT 2023 , Edited by admin on Sat Dec 16 12:05:30 GMT 2023
PRIMARY