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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H21NO3
Molecular Weight 311.3757
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRONUCIFERINE, (-)-

SMILES

CN1CCc2cc(c(c3c2[C@]1([H])CC43C=CC(=O)C=C4)OC)OC

InChI

InChIKey=WUYQEGNOQLRQAQ-AWEZNQCLSA-N
InChI=1S/C19H21NO3/c1-20-9-6-12-10-15(22-2)18(23-3)17-16(12)14(20)11-19(17)7-4-13(21)5-8-19/h4-5,7-8,10,14H,6,9,11H2,1-3H3/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H21NO3
Molecular Weight 311.3757
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 00:32:53 UTC 2021
Edited
by admin
on Sat Jun 26 00:32:53 UTC 2021
Record UNII
RPT0IU7P8P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PRONUCIFERINE, (-)-
Common Name English
N,O-DIMETHYLCROTSPARINE
Common Name English
(-)-PRONUCIFERINE
Common Name English
SPIRO(2,5-CYCLOHEXADIENE-1,7'(1'H)-CYCLOPENT(IJ)ISOQUINOLIN)-4-ONE, 2',3',8',8'A-TETRAHYDRO-5',6'-DIMETHOXY-1'-METHYL-, (S)-
Common Name English
CROTSPARINE, N,O-DIMETHYL-
Common Name English
6A.ALPHA.-PRONUCIFERINE
Common Name English
SPIRO(2,5-CYCLOHEXADIENE-1,7'(1'H)-CYCLOPENT(IJ)ISOQUINOLIN)-4-ONE, 2',3',8',8'A-TETRAHYDRO-5',6'-DIMETHOXY-1'-METHYL-, (8'AS)-
Common Name English
Code System Code Type Description
PUBCHEM
793841
Created by admin on Sat Jun 26 00:32:53 UTC 2021 , Edited by admin on Sat Jun 26 00:32:53 UTC 2021
PRIMARY
CAS
16654-37-8
Created by admin on Sat Jun 26 00:32:53 UTC 2021 , Edited by admin on Sat Jun 26 00:32:53 UTC 2021
PRIMARY
FDA UNII
RPT0IU7P8P
Created by admin on Sat Jun 26 00:32:53 UTC 2021 , Edited by admin on Sat Jun 26 00:32:53 UTC 2021
PRIMARY
EPA CompTox
16654-37-8
Created by admin on Sat Jun 26 00:32:53 UTC 2021 , Edited by admin on Sat Jun 26 00:32:53 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT