RWJ-443931

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C39H45NO7
Molecular Weight	639.7771
Optical Activity	( + )
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(C)C(=O)OC1=CC2=C(C=C1)C3=C(CO2)C4=C(O[C@@H]3C5=CC=C(OCCN6CCCCC6)C=C5)C=C(OC(=O)C(C)(C)C)C=C4

InChI

InChIKey=HFEFFYLNWHUHTO-PGUFJCEWSA-N

InChI=1S/C39H45NO7/c1-38(2,3)36(41)45-27-15-17-30-32(22-27)44-24-31-29-16-14-28(46-37(42)39(4,5)6)23-33(29)47-35(34(30)31)25-10-12-26(13-11-25)43-21-20-40-18-8-7-9-19-40/h10-17,22-23,35H,7-9,18-21,24H2,1-6H3/t35-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C39H45NO7
Molecular Weight	639.7771
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:08:02 GMT 2023` Edited by `admin` on `Sat Dec 16 19:08:02 GMT 2023`
Record UNII	EU9DD7762T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RWJ-443931

Code

English

BIS(2,2-DIMETHYLPROPIONIC ACID) 5(R)-(4-(2-(1-PIPERIDINYL)ETHOXY)PHENYL)-5,11-DIHYDRO-1-BENZOPYRAN(4,3-C)(1)BENZOPYRAN-2,8-DIYL DIESTER

Systematic Name

English

RWJ443931

Code

English

PROPANOIC ACID, 2,2-DIMETHYL-, 1,1'-((5R)-5,11-DIHYDRO-5-(4-(2-(1-PIPERIDINYL)ETHOXY)PHENYL)(1)BENZOPYRANO(4,3-C)(1)BENZOPYRAN-2,8-DIYL) ESTER

Systematic Name

English

1,1'-((5R)-5,11-DIHYDRO-5-(4-(2-(1-PIPERIDINYL)ETHOXY)PHENYL)(1)BENZOPYRANO(4,3-C)(1)BENZOPYRAN-2,8-DIYL) BIS(2,2-DIMETHYLPROPANOATE)

Systematic Name

English

Code System Code Type Description

FDA UNII

EU9DD7762T

Created by admin on Sat Dec 16 19:08:03 GMT 2023 , Edited by admin on Sat Dec 16 19:08:03 GMT 2023

PRIMARY

CAS

554429-88-8

Created by admin on Sat Dec 16 19:08:03 GMT 2023 , Edited by admin on Sat Dec 16 19:08:03 GMT 2023

PRIMARY

PUBCHEM

10218853

Created by admin on Sat Dec 16 19:08:03 GMT 2023 , Edited by admin on Sat Dec 16 19:08:03 GMT 2023

PRIMARY

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ESTROGEN RECEPTOR

TARGET->MODULATOR

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					EU9DD7762T

RWJ-443931

ACTIVE MOIETY

Amount: