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Details

Stereochemistry ACHIRAL
Molecular Formula C23H26NO3
Molecular Weight 364.4574
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of TRANTELINIUM

SMILES

C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C3C4=CC=CC=C4OC5=C3C=CC=C5

InChI

InChIKey=KBVFFWSKLQHNSS-FVQHAEBGSA-N
InChI=1S/C23H26NO3/c1-24(2)15-11-12-16(24)14-17(13-15)26-23(25)22-18-7-3-5-9-20(18)27-21-10-6-4-8-19(21)22/h3-10,15-17,22H,11-14H2,1-2H3/q+1/t15-,16+,17+

HIDE SMILES / InChI

Molecular Formula C23H26NO3
Molecular Weight 364.4574
Charge 1
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

PubMed

PubMed

TitleDatePubMed
[The effect of organic phosphoric esters on the experimental peptic ulcer (author's transl)].
1978 Dec
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:34:43 GMT 2023
Edited
by admin
on Sat Dec 16 08:34:43 GMT 2023
Record UNII
84F4DRV925
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRANTELINIUM
Common Name English
TRANTELINIUM CATION
Common Name English
1.ALPHA.H,5.ALPHA.H-TROPANIUM, 3.ALPHA.-HYDROXY-8-METHYL-, XANTHENE-9-CARBOXYLATE (ESTER)
Common Name English
TRANTELINIUM ION
Common Name English
Code System Code Type Description
PUBCHEM
71532
Created by admin on Sat Dec 16 08:34:44 GMT 2023 , Edited by admin on Sat Dec 16 08:34:44 GMT 2023
PRIMARY
FDA UNII
84F4DRV925
Created by admin on Sat Dec 16 08:34:44 GMT 2023 , Edited by admin on Sat Dec 16 08:34:44 GMT 2023
PRIMARY
CAS
22059-05-8
Created by admin on Sat Dec 16 08:34:44 GMT 2023 , Edited by admin on Sat Dec 16 08:34:44 GMT 2023
PRIMARY
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SALT/SOLVATE -> PARENT
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