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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H43NO.ClH
Molecular Weight 434.097
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOLANIDINE HYDROCHLORIDE

SMILES

Cl.[H][C@]12CC[C@H](C)CN1[C@@]3([H])C[C@@]4([H])[C@]5([H])CC=C6C[C@@H](O)CC[C@]6(C)[C@@]5([H])CC[C@]4(C)[C@@]3([H])[C@@H]2C

InChI

InChIKey=GFSDTBOYJKNJHE-QQGZXNMISA-N
InChI=1S/C27H43NO.ClH/c1-16-5-8-23-17(2)25-24(28(23)15-16)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4;/h6,16-17,19-25,29H,5,7-15H2,1-4H3;1H/t16-,17+,19-,20+,21-,22-,23+,24-,25-,26-,27-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SOLANIDINE HYDROCHLORIDE
MI  
Common Name English
SOLANIDINE HYDROCHLORIDE [MI]
Common Name English
SOLANID-5-EN-3-OL, HYDROCHLORIDE, (3.BETA.)-
Common Name English
Code System Code Type Description
MERCK INDEX
m10101
Created by admin on Sat Dec 16 09:36:17 UTC 2023 , Edited by admin on Sat Dec 16 09:36:17 UTC 2023
PRIMARY Merck Index
PUBCHEM
6452525
Created by admin on Sat Dec 16 09:36:17 UTC 2023 , Edited by admin on Sat Dec 16 09:36:17 UTC 2023
PRIMARY
FDA UNII
661IG2L918
Created by admin on Sat Dec 16 09:36:17 UTC 2023 , Edited by admin on Sat Dec 16 09:36:17 UTC 2023
PRIMARY
ECHA (EC/EINECS)
225-973-0
Created by admin on Sat Dec 16 09:36:17 UTC 2023 , Edited by admin on Sat Dec 16 09:36:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID20966215
Created by admin on Sat Dec 16 09:36:17 UTC 2023 , Edited by admin on Sat Dec 16 09:36:17 UTC 2023
PRIMARY
CAS
5189-62-8
Created by admin on Sat Dec 16 09:36:17 UTC 2023 , Edited by admin on Sat Dec 16 09:36:17 UTC 2023
PRIMARY