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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H22N2O2.BrH
Molecular Weight 391.302
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SARPAGINE HYDROBROMIDE

SMILES

Br.[H][C@]12CC3=C(NC4=C3C=C(O)C=C4)[C@]5([H])C[C@H]([C@H]1CO)\C(CN25)=C/C

InChI

InChIKey=HQUJQNUPPADORW-PHYMNTMZSA-N
InChI=1S/C19H22N2O2.BrH/c1-2-10-8-21-17-7-14-13-5-11(23)3-4-16(13)20-19(14)18(21)6-12(10)15(17)9-22;/h2-5,12,15,17-18,20,22-23H,6-9H2,1H3;1H/b10-2-;/t12-,15+,17-,18-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C19H22N2O2
Molecular Weight 310.3902
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 1
Optical Activity UNSPECIFIED

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 20:27:37 GMT 2023
Edited
by admin
on Fri Dec 15 20:27:37 GMT 2023
Record UNII
0714E43838
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SARPAGINE HYDROBROMIDE
Common Name English
SARPAGAN-10,17-DIOL, HYDROBROMIDE (1:1)
Common Name English
RAUPINE HYDROBROMIDE
Common Name English
Code System Code Type Description
CAS
1079392-21-4
Created by admin on Fri Dec 15 20:27:37 GMT 2023 , Edited by admin on Fri Dec 15 20:27:37 GMT 2023
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EPA CompTox
DTXSID80148333
Created by admin on Fri Dec 15 20:27:37 GMT 2023 , Edited by admin on Fri Dec 15 20:27:37 GMT 2023
PRIMARY
FDA UNII
0714E43838
Created by admin on Fri Dec 15 20:27:37 GMT 2023 , Edited by admin on Fri Dec 15 20:27:37 GMT 2023
PRIMARY
PUBCHEM
71587923
Created by admin on Fri Dec 15 20:27:37 GMT 2023 , Edited by admin on Fri Dec 15 20:27:37 GMT 2023
PRIMARY