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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H21NO4.ClH
Molecular Weight 363.835
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BOLDINE HYDROCHLORIDE

SMILES

Cl.[H][C@]12CC3=CC(O)=C(OC)C=C3C4=C1C(CCN2C)=CC(O)=C4OC

InChI

InChIKey=MUGNKMCHLPQCMV-ZOWNYOTGSA-N
InChI=1S/C19H21NO4.ClH/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18;/h7-9,13,21-22H,4-6H2,1-3H3;1H/t13-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C19H21NO4
Molecular Weight 327.3743
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:40:14 UTC 2023
Edited
by admin
on Sat Dec 16 09:40:14 UTC 2023
Record UNII
G6R77KSG8R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BOLDINE HYDROCHLORIDE
Common Name English
6A.ALPHA.-APORPHINE-2,9-DIOL, 1,10-DIMETHOXY-, HYDROCHLORIDE
Systematic Name English
4H-DIBENZO(DE,G)QUINOLINE-2,9-DIOL, 5,6,6A,7-TETRAHYDRO-1,10-DIMETHOXY-6-METHYL-, HYDROCHLORIDE, (6AS)-
Systematic Name English
4H-DIBENZO(DE,G)QUINOLINE-2,9-DIOL, 5,6,6A,7-TETRAHYDRO-1,10-DIMETHOXY-6-METHYL-, HYDROCHLORIDE, (S)-
Systematic Name English
BOLDINE HYDROCHLORIDE, (+)-
Common Name English
4H-DIBENZO(DE,G)QUINOLINE-2,9-DIOL, 5,6,6A,7-TETRAHYDRO-1,10-DIMETHOXY-6-METHYL-, HYDROCHLORIDE (1:1), (6AS)-
Systematic Name English
5,6,6A,7-TETRAHYDRO-2,9-DIHYDROXY-1,10-DIMETHOXY-6-METHYL-4H-DIBENZO(DE,G)QUINOLINIUM CHLORIDE
Common Name English
Code System Code Type Description
PUBCHEM
45045237
Created by admin on Sat Dec 16 09:40:14 UTC 2023 , Edited by admin on Sat Dec 16 09:40:14 UTC 2023
PRIMARY
EPA CompTox
DTXSID00937180
Created by admin on Sat Dec 16 09:40:14 UTC 2023 , Edited by admin on Sat Dec 16 09:40:14 UTC 2023
PRIMARY
CAS
16625-69-7
Created by admin on Sat Dec 16 09:40:14 UTC 2023 , Edited by admin on Sat Dec 16 09:40:14 UTC 2023
PRIMARY
FDA UNII
G6R77KSG8R
Created by admin on Sat Dec 16 09:40:14 UTC 2023 , Edited by admin on Sat Dec 16 09:40:14 UTC 2023
PRIMARY
ECHA (EC/EINECS)
240-675-0
Created by admin on Sat Dec 16 09:40:14 UTC 2023 , Edited by admin on Sat Dec 16 09:40:14 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY