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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H12O2
Molecular Weight 224.2546
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

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

SMILES

O=C1C[C@H](OC2=CC=CC=C12)C3=CC=CC=C3

InChI

InChIKey=ZONYXWQDUYMKFB-HNNXBMFYSA-N
InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H12O2
Molecular Weight 224.2546
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens.
2001 Mar
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 18:58:11 UTC 2023
Edited
by admin
on Sat Dec 16 18:58:11 UTC 2023
Record UNII
N50DYZ2H5Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLAVANONE, (-)-
Systematic Name English
FLAVANONE, (S)-(-)-
Systematic Name English
4H-1-BENZOPYRAN-4-ONE, 2,3-DIHYDRO-2-PHENYL-, (2S)-
Systematic Name English
(2S)-FLAVANONE
Systematic Name English
94166II
Code English
(S)-2-PHENYL-4-CHROMANONE
Systematic Name English
(-)-FLAVANONE
Systematic Name English
(S)-2-PHENYL-3,4-DIHYDRO-2H-BENZOPYRAN-4-ONE
Systematic Name English
Code System Code Type Description
CHEBI
15606
Created by admin on Sat Dec 16 18:58:11 UTC 2023 , Edited by admin on Sat Dec 16 18:58:11 UTC 2023
PRIMARY
CAS
17002-31-2
Created by admin on Sat Dec 16 18:58:11 UTC 2023 , Edited by admin on Sat Dec 16 18:58:11 UTC 2023
PRIMARY
FDA UNII
N50DYZ2H5Q
Created by admin on Sat Dec 16 18:58:11 UTC 2023 , Edited by admin on Sat Dec 16 18:58:11 UTC 2023
PRIMARY
CHEBI
140377
Created by admin on Sat Dec 16 18:58:11 UTC 2023 , Edited by admin on Sat Dec 16 18:58:11 UTC 2023
PRIMARY
PUBCHEM
439652
Created by admin on Sat Dec 16 18:58:11 UTC 2023 , Edited by admin on Sat Dec 16 18:58:11 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER