(αS)-3-Amino-α-[[[(1R)-2-(4-methoxyphenyl)-1-methylethyl](phenylmethyl)amino]methyl]-4-(phenylmethoxy)benzenemethanol

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H36N2O3
Molecular Weight	496.6398
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (αS)-3-Amino-α-[[[(1R)-2-(4-methoxyphenyl)-1-methylethyl](phenylmethyl)amino]methyl]-4-(phenylmethoxy)benzenemethanol

Structure Search

SMILES

COC1=CC=C(C[C@@H](C)N(C[C@@H](O)C2=CC(N)=C(OCC3=CC=CC=C3)C=C2)CC4=CC=CC=C4)C=C1

InChI

InChIKey=TVLLMHMSGGBZNO-WBBHLRKXSA-N

InChI=1S/C32H36N2O3/c1-24(19-25-13-16-29(36-2)17-14-25)34(21-26-9-5-3-6-10-26)22-31(35)28-15-18-32(30(33)20-28)37-23-27-11-7-4-8-12-27/h3-18,20,24,31,35H,19,21-23,33H2,1-2H3/t24-,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C32H36N2O3
Molecular Weight	496.6398
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 `Sat Dec 16 19:29:54 GMT 2023` Edited by `admin` on `Sat Dec 16 19:29:54 GMT 2023`
Record UNII	CM4WFY22FU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(αS)-3-Amino-α-[[[(1R)-2-(4-methoxyphenyl)-1-methylethyl](phenylmethyl)amino]methyl]-4-(phenylmethoxy)benzenemethanol

Systematic Name

English

Benzenemethanol, 3-amino-α-[[[(1R)-2-(4-methoxyphenyl)-1-methylethyl](phenylmethyl)amino]methyl]-4-(phenylmethoxy)-, (αS)-

Systematic Name

English

Code System Code Type Description

FDA UNII

CM4WFY22FU

Created by admin on Sat Dec 16 19:29:54 GMT 2023 , Edited by admin on Sat Dec 16 19:29:54 GMT 2023

PRIMARY

PUBCHEM

29973294

Created by admin on Sat Dec 16 19:29:54 GMT 2023 , Edited by admin on Sat Dec 16 19:29:54 GMT 2023

PRIMARY

CAS

289657-25-6

Created by admin on Sat Dec 16 19:29:54 GMT 2023 , Edited by admin on Sat Dec 16 19:29:54 GMT 2023

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