NADOLOL DIMER

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 Search

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

Molecular Formula	C30H43NO8
Molecular Weight	545.6643
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	4 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:16:10 UTC 2023` Edited by `admin` on `Sat Dec 16 11:16:10 UTC 2023`
Record UNII	LCQ1J4UPF9
Record Status	`Validated (UNII)`
Record Version

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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 UTC 2023 , Edited by admin on Sat Dec 16 11:16:10 UTC 2023

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

LCQ1J4UPF9

Created by admin on Sat Dec 16 11:16:10 UTC 2023 , Edited by admin on Sat Dec 16 11:16:10 UTC 2023

PRIMARY

PUBCHEM

154926038

Created by admin on Sat Dec 16 11:16:10 UTC 2023 , Edited by admin on Sat Dec 16 11:16:10 UTC 2023

PRIMARY

Related Record Type Details


					FEN504330V

NADOLOL

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