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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H21NO6
Molecular Weight 383.3945
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDRASTINE

SMILES

[H][C@@]1(OC(=O)C2=C1C=CC(OC)=C2OC)[C@]3([H])N(C)CCC4=C3C=C5OCOC5=C4

InChI

InChIKey=JZUTXVTYJDCMDU-MOPGFXCFSA-N
InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19+/m1/s1

HIDE SMILES / InChI
Molecular Formula C21H21NO6
Molecular Weight 383.3945
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:08:43 UTC 2023
Edited
by admin
on Fri Dec 15 15:08:43 UTC 2023
Record UNII
8890V3217X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDRASTINE
MI   USP-RS   WHO-DD  
Common Name English
NSC-757430
Code English
Hydrastine [WHO-DD]
Common Name English
HYDRASTINE (CONSTITUENT OF GOLDENSEAL) [DSC]
Common Name English
HYDRASTINE [USP-RS]
Common Name English
HYDRASTINE [MI]
Common Name English
PHTHALIDE (S)-6,7-DIMETHOXY-3-(R)-(5,6,7,8-TETRAHYDRO-6-METHYL-1,3-DIOXOLO(4,5-G)ISOQUINOLIN-5-YL)-
Common Name English
(S)-6,7-Dimethoxy-3-(R)-(6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)isobenzofuran-1(3H)-one
Systematic Name English
Classification Tree Code System Code
DSLD 1119 (Number of products:5)
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
NCI_THESAURUS C221
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C76031
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
WIKIPEDIA
Hydrastine
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
CAS
118-08-1
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
FDA UNII
8890V3217X
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
EPA CompTox
DTXSID9025409
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
PUBCHEM
197835
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
RS_ITEM_NUM
1313210
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
NSC
757430
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
ChEMBL
CHEMBL1256919
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
ECHA (EC/EINECS)
204-233-0
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
MESH
C013024
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY
MERCK INDEX
m6076
Created by admin on Fri Dec 15 15:08:43 UTC 2023 , Edited by admin on Fri Dec 15 15:08:43 UTC 2023
PRIMARY Merck Index
Related Record Type Details
Structure of HYDRASTINE HYDROCHLORIDE
SALT/SOLVATE -> PARENT
Structure of HYDRASTINE HYDROCHLORIDE
SALT/SOLVATE -> PARENT
GOLDENSEAL
PARENT -> CONSTITUENT ALWAYS PRESENT
Related Record Type Details
Structure of HYDRASTINE
ACTIVE MOIETY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966