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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28N2O8
Molecular Weight 424.4457
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PINDOLOL GLUCURONIDE, (S)-

SMILES

CC(C)NC[C@@]([H])(COc1cccc2c1cc[nH]2)O[C@@]3([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O)O3)O)O)O

InChI

InChIKey=DZDGVZYNAMIJIW-WIZZQEHRSA-N
InChI=1S/C20H28N2O8/c1-10(2)22-8-11(9-28-14-5-3-4-13-12(14)6-7-21-13)29-20-17(25)15(23)16(24)18(30-20)19(26)27/h3-7,10-11,15-18,20-25H,8-9H2,1-2H3,(H,26,27)/t11-,15-,16-,17+,18-,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H28N2O8
Molecular Weight 424.4457
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 13:47:52 UTC 2021
Edited
by admin
on Sat Jun 26 13:47:52 UTC 2021
Record UNII
038V80LNE0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PINDOLOL GLUCURONIDE, (S)-
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 2-(1H-INDOL-4-YLOXY)-1-(((1-METHYLETHYL)AMINO)METHYL)ETHYL, (S)-
Systematic Name English
Code System Code Type Description
CAS
58670-82-9
Created by admin on Sat Jun 26 13:47:52 UTC 2021 , Edited by admin on Sat Jun 26 13:47:52 UTC 2021
PRIMARY
PUBCHEM
91810527
Created by admin on Sat Jun 26 13:47:52 UTC 2021 , Edited by admin on Sat Jun 26 13:47:52 UTC 2021
PRIMARY
FDA UNII
038V80LNE0
Created by admin on Sat Jun 26 13:47:52 UTC 2021 , Edited by admin on Sat Jun 26 13:47:52 UTC 2021
PRIMARY
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