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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H19NO4.ClH
Molecular Weight 349.809
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Norisoboldine hydrochloride, (+)-

SMILES

Cl.COC1=CC2=C3[C@H](CC4=CC(O)=C(OC)C=C4C3=C1O)NCC2

InChI

InChIKey=POXNVTUOIYRUGG-YDALLXLXSA-N
InChI=1S/C18H19NO4.ClH/c1-22-14-8-11-10(6-13(14)20)5-12-16-9(3-4-19-12)7-15(23-2)18(21)17(11)16;/h6-8,12,19-21H,3-5H2,1-2H3;1H/t12-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H19NO4
Molecular Weight 313.3478
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

PubMed

PubMed

TitleDatePubMed
Pessoine and spinosine, two catecholic berbines from Annona spinescens.
1996-04
Substance Class Chemical
Created
by admin
on Wed Apr 02 16:57:53 GMT 2025
Edited
by admin
on Wed Apr 02 16:57:53 GMT 2025
Record UNII
684KB7DU2T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4H-Dibenzo[de,g]quinoline-1,9-diol, 5,6,6a,7-tetrahydro-2,10-dimethoxy-, hydrochloride, (S)-
Preferred Name English
Norisoboldine hydrochloride, (+)-
Common Name English
Code System Code Type Description
FDA UNII
684KB7DU2T
Created by admin on Wed Apr 02 16:57:53 GMT 2025 , Edited by admin on Wed Apr 02 16:57:53 GMT 2025
PRIMARY
PUBCHEM
162642148
Created by admin on Wed Apr 02 16:57:53 GMT 2025 , Edited by admin on Wed Apr 02 16:57:53 GMT 2025
PRIMARY
CAS
5083-84-1
Created by admin on Wed Apr 02 16:57:53 GMT 2025 , Edited by admin on Wed Apr 02 16:57:53 GMT 2025
PRIMARY
Related Record Type Details
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