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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H12O5
Molecular Weight 272.2528
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,6A,9-TRIHYDROXYPTEROCARPAN

SMILES

[H][C@@]12OC3=CC(O)=CC=C3[C@]1(O)COC4=CC(O)=CC=C24

InChI

InChIKey=QMXOFBXZEKTJIK-LSDHHAIUSA-N
InChI=1S/C15H12O5/c16-8-1-3-10-12(5-8)19-7-15(18)11-4-2-9(17)6-13(11)20-14(10)15/h1-6,14,16-18H,7H2/t14-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H12O5
Molecular Weight 272.2528
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 Fri Dec 15 18:32:13 GMT 2023
Edited
by admin
on Fri Dec 15 18:32:13 GMT 2023
Record UNII
Q0O9HGR94O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,6A,9-TRIHYDROXYPTEROCARPAN
Common Name English
6H-BENZOFURO(3,2-C)(1)BENZOPYRAN-3,6A,9(11AH)-TRIOL, (6AS-CIS)-
Common Name English
(-)-GLYCINOL
Systematic Name English
6H-BENZOFURO(3,2-C)(1)BENZOPYRAN-3,6A,9(11AH)-TRIOL, (6AS,11AS)-
Common Name English
GLYCINOL
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Glycinol (pterocarpan)
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY
CHEBI
16000
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY
MESH
C540862
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY
CAS
69393-95-9
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY
FDA UNII
Q0O9HGR94O
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY
CHEBI
15649
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID20989207
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY
PUBCHEM
129648
Created by admin on Fri Dec 15 18:32:13 GMT 2023 , Edited by admin on Fri Dec 15 18:32:13 GMT 2023
PRIMARY