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 11 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOLASODINE

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC=C5C[C@@H](O)CC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@H](C)[C@@]6(CC[C@@H](C)CN6)O2

InChI

InChIKey=KWVISVAMQJWJSZ-VKROHFNGSA-N
InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H43NO2
Molecular Weight 413.6358
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 11
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:00:56 UTC 2023
Edited
by admin
on Sat Dec 16 08:00:56 UTC 2023
Record UNII
L40Y453Y96
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SOLASODINE
MI  
Common Name English
SOLASOD-5-EN-3.BETA.-OL
Common Name English
SPIROSOL-5-EN-3-OL, (3.BETA.,22.ALPHA.,25R)-
Common Name English
SOLASADINE
Common Name English
SOLANEARPIDINE
Common Name English
SOLASODIN
Common Name English
SOLANIDINE-S
Common Name English
NSC-178260
Code English
SOLANCARPIDINE
Common Name English
Solasodine [WHO-DD]
Common Name English
PURAPURIDINE
Common Name English
(-)-SOLASODINE
Common Name English
(3.BETA.,22.ALPHA.,25R)-SPIROSOL-5-EN-3-OL
Systematic Name English
SOLASODINE [MI]
Common Name English
NSC-179187
Code English
Code System Code Type Description
CHEBI
145043
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
PUBCHEM
442985
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
CAS
126-17-0
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
NSC
178260
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
NSC
179187
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
WIKIPEDIA
Solasodine
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
FDA UNII
L40Y453Y96
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
ECHA (EC/EINECS)
204-774-2
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
EPA CompTox
DTXSID101030558
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
MERCK INDEX
m10106
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY Merck Index
HSDB
3538
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY
CHEBI
9190
Created by admin on Sat Dec 16 08:00:56 UTC 2023 , Edited by admin on Sat Dec 16 08:00:56 UTC 2023
PRIMARY