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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H29FN6O11
Molecular Weight 620.5415
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RALTEGRAVIR BETA-D-GLUCURONIDE

SMILES

Cc1nnc(C(=O)NC(C)(C)c2nc(c(c(=O)n2C)O[C@@]3([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O)O3)O)O)O)C(=NCc4ccc(cc4)F)O)o1

InChI

InChIKey=DNIJULFVNPGGMF-LKUMGPRMSA-N
InChI=1S/C26H29FN6O11/c1-10-31-32-21(42-10)20(38)30-26(2,3)25-29-13(19(37)28-9-11-5-7-12(27)8-6-11)17(22(39)33(25)4)43-24-16(36)14(34)15(35)18(44-24)23(40)41/h5-8,14-16,18,24,34-36H,9H2,1-4H3,(H,28,37)(H,30,38)(H,40,41)/t14-,15-,16+,18-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H29FN6O11
Molecular Weight 620.5415
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 14:08:27 UTC 2021
Edited
by admin
on Sat Jun 26 14:08:27 UTC 2021
Record UNII
Q53CNM2XZH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RALTEGRAVIR BETA-D-GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-((((4-FLUOROPHENYL)METHYL)AMINO)CARBONYL)-1,6-DIHYDRO-1-METHYL-2-(1-METHYL-1-(((5-METHYL-1,3,4-OXADIAZOL-2-YL)CARBONYL)AMINO)ETHYL)-6-OXOPYRIMIDIN-5-YL
Common Name English
RALTEGRAVIR .BETA.-D-GLUCURONIDE
Common Name English
RALTEGRAVIR M2
Common Name English
Code System Code Type Description
FDA UNII
Q53CNM2XZH
Created by admin on Sat Jun 26 14:08:27 UTC 2021 , Edited by admin on Sat Jun 26 14:08:27 UTC 2021
PRIMARY
CAS
952654-62-5
Created by admin on Sat Jun 26 14:08:27 UTC 2021 , Edited by admin on Sat Jun 26 14:08:27 UTC 2021
PRIMARY
PUBCHEM
49849448
Created by admin on Sat Jun 26 14:08:27 UTC 2021 , Edited by admin on Sat Jun 26 14:08:27 UTC 2021
PRIMARY
Related Record Type Details
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