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Details

Stereochemistry EPIMERIC
Molecular Formula C25H29N3O2
Molecular Weight 403.5176
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(4-((2S,5S)-2,5-BIS(4-AMINOPHENYL)PYRROLIDIN-1-YL)PHENYL)PROPANE-1,2-DIOL

SMILES

CC(CO)(c1ccc(cc1)N2[C@@]([H])(CC[C@@]2([H])c3ccc(cc3)N)c4ccc(cc4)N)O

InChI

InChIKey=DOIJKPAXNDKTLI-JWDFLIAJSA-N
InChI=1S/C25H29N3O2/c1-25(30,16-29)19-6-12-22(13-7-19)28-23(17-2-8-20(26)9-3-17)14-15-24(28)18-4-10-21(27)11-5-18/h2-13,23-24,29-30H,14-16,26-27H2,1H3/t23-,24-,25?/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H29N3O2
Molecular Weight 403.5176
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 14:06:42 UTC 2021
Edited
by admin
on Sat Jun 26 14:06:42 UTC 2021
Record UNII
84FPJ9E66Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(4-((2S,5S)-2,5-BIS(4-AMINOPHENYL)PYRROLIDIN-1-YL)PHENYL)PROPANE-1,2-DIOL
Systematic Name English
OMBITASVIR METABOLITE M35
Common Name English
Code System Code Type Description
FDA UNII
84FPJ9E66Y
Created by admin on Sat Jun 26 14:06:42 UTC 2021 , Edited by admin on Sat Jun 26 14:06:42 UTC 2021
PRIMARY
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