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Details

Stereochemistry MIXED
Molecular Formula C30H43NO8
Molecular Weight 545.6643
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NADOLOL DIMER

SMILES

CC(C)(C)N(CC(O)COC1=CC=CC2=C1C[C@H](O)[C@H](O)C2)CC(O)COC3=C4C[C@H](O)[C@H](O)CC4=CC=C3

InChI

InChIKey=QTDWBPBQCMSEPA-UBHFVJRSSA-N
InChI=1S/C30H43NO8/c1-30(2,3)31(14-20(32)16-38-28-8-4-6-18-10-24(34)26(36)12-22(18)28)15-21(33)17-39-29-9-5-7-19-11-25(35)27(37)13-23(19)29/h4-9,20-21,24-27,32-37H,10-17H2,1-3H3/t20?,21?,24-,25-,26+,27+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
NADOLOL DIMER
Common Name English
2,3-NAPHTHALENEDIOL, 5,5'-(((1,1-DIMETHYLETHYL)IMINO)BIS((2-HYDROXY-3,1-PROPANEDIYL)OXY))BIS(1,2,3,4-TETRAHYDRO-
Systematic Name English
(2SR,3RS)-5-(3-(TERT-BUTYL(3-(((6RS,7SR)-6,7-DIHYDROXY-5,6,7,8-TETRAHYDRONAPHTHALEN-1-YL)OXY)-2-HYDROXYPROPYL)AMINO)-2-HYDROXYPROPOXY)-1,2,3,4-TETRAHYDRONAPHTHALENE-2,3-DIOL
Systematic Name English
Code System Code Type Description
CAS
67247-26-1
Created by admin on Sat Dec 16 11:16:10 GMT 2023 , Edited by admin on Sat Dec 16 11:16:10 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
LCQ1J4UPF9
Created by admin on Sat Dec 16 11:16:10 GMT 2023 , Edited by admin on Sat Dec 16 11:16:10 GMT 2023
PRIMARY
PUBCHEM
154926038
Created by admin on Sat Dec 16 11:16:10 GMT 2023 , Edited by admin on Sat Dec 16 11:16:10 GMT 2023
PRIMARY