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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H39NO8
Molecular Weight 589.6754
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (5R,6S)-5,6,7,8-TETRAHYDRO-6-PHENYL-5-(4-(2-(1-PYRROLIDINYL)ETHOXY)PHENYL)-2-NAPHTHALEN .BETA.-D-GLUCOPYRANOSIDURONIC ACID

SMILES

O[C@@H]1[C@@H](O)[C@H](OC2=CC=C3[C@H]([C@H](CCC3=C2)C4=CC=CC=C4)C5=CC=C(OCCN6CCCC6)C=C5)O[C@@H]([C@H]1O)C(O)=O

InChI

InChIKey=WBWCSRRUQKSEDJ-WIYFCYHXSA-N
InChI=1S/C34H39NO8/c36-29-30(37)32(33(39)40)43-34(31(29)38)42-25-13-15-27-23(20-25)10-14-26(21-6-2-1-3-7-21)28(27)22-8-11-24(12-9-22)41-19-18-35-16-4-5-17-35/h1-3,6-9,11-13,15,20,26,28-32,34,36-38H,4-5,10,14,16-19H2,(H,39,40)/t26-,28+,29+,30+,31-,32+,34-/m1/s1

HIDE SMILES / InChI

Molecular Formula C34H39NO8
Molecular Weight 589.6754
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 21:27:32 UTC 2023
Edited
by admin
on Thu Jul 06 21:27:32 UTC 2023
Record UNII
GY8G45GVI4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(5R,6S)-5,6,7,8-TETRAHYDRO-6-PHENYL-5-(4-(2-(1-PYRROLIDINYL)ETHOXY)PHENYL)-2-NAPHTHALEN .BETA.-D-GLUCOPYRANOSIDURONIC ACID
Systematic Name English
LASOFOXIFENE METABOLITE M7
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (5R,6S)-5,6,7,8-TETRAHYDRO-6-PHENYL-5-(4-(2-(1-PYRROLIDINYL)ETHOXY)PHENYL)-2-NAPHTHALEN
Systematic Name English
Code System Code Type Description
CAS
1048953-95-2
Created by admin on Thu Jul 06 21:27:33 UTC 2023 , Edited by admin on Thu Jul 06 21:27:33 UTC 2023
PRIMARY
PUBCHEM
71749751
Created by admin on Thu Jul 06 21:27:33 UTC 2023 , Edited by admin on Thu Jul 06 21:27:33 UTC 2023
PRIMARY
FDA UNII
GY8G45GVI4
Created by admin on Thu Jul 06 21:27:33 UTC 2023 , Edited by admin on Thu Jul 06 21:27:33 UTC 2023
PRIMARY
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