U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H43NO2
Molecular Weight 413.6358
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VERALKAMINE

SMILES

C[C@H]([C@@H]1CC[C@H](C)CN1)[C@]2(C)[C@@H](O)C[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4CC=C23

InChI

InChIKey=DMLNDBOUFBIGIL-YEJULBKSSA-N
InChI=1S/C27H43NO2/c1-16-5-10-24(28-15-16)17(2)27(4)23-9-8-22-20(21(23)14-25(27)30)7-6-18-13-19(29)11-12-26(18,22)3/h6,9,16-17,19-22,24-25,28-30H,5,7-8,10-15H2,1-4H3/t16-,17+,19-,20-,21-,22-,24-,25-,26-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H43NO2
Molecular Weight 413.6358
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:40:32 GMT 2025
Edited
by admin
on Mon Mar 31 22:40:32 GMT 2025
Record UNII
B3E05ZZ3JH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VERALKAMINE
MI  
Common Name English
VERALCAMINE
Preferred Name English
VERALKAMINE [MI]
Common Name English
18-NORPREGNA-5,12-DIENE-3,16-DIOL, 17-METHYL-20-((2S,5S)-5-METHYL-2-PIPERIDINYL)-, (3.BETA.,16.BETA.,17.ALPHA.,20S)-
Systematic Name English
Code System Code Type Description
CAS
17155-31-6
Created by admin on Mon Mar 31 22:40:32 GMT 2025 , Edited by admin on Mon Mar 31 22:40:32 GMT 2025
PRIMARY
MERCK INDEX
m11413
Created by admin on Mon Mar 31 22:40:32 GMT 2025 , Edited by admin on Mon Mar 31 22:40:32 GMT 2025
PRIMARY Merck Index
FDA UNII
B3E05ZZ3JH
Created by admin on Mon Mar 31 22:40:32 GMT 2025 , Edited by admin on Mon Mar 31 22:40:32 GMT 2025
PRIMARY
PUBCHEM
12444724
Created by admin on Mon Mar 31 22:40:32 GMT 2025 , Edited by admin on Mon Mar 31 22:40:32 GMT 2025
PRIMARY