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

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H23NO6.ClH
Molecular Weight 361.818
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONOCROTALINE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12[C@H]3CCN1CC=C2COC(=O)[C@](C)(O)[C@](C)(O)[C@@H](C)C(=O)O3

InChI

InChIKey=DYMOTPRLTOPMKK-HIKKEBQLSA-N
InChI=1S/C16H23NO6.ClH/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20;/h4,9,11-12,20-21H,5-8H2,1-3H3;1H/t9-,11+,12+,15+,16-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MONOCROTALINE HYDROCHLORIDE
Common Name English
MONOCROTALINE, HYDROCHLORIDE
Common Name English
20-NORCROTALANAN-11,15-DIONE, 14,19-DIHYDRO-12,13-DIHYDROXY-, HYDROCHLORIDE, (13.ALPHA.,14.ALPHA.)-
Common Name English
MONOCROTALINE HYDROC [MI]
Common Name English
Code System Code Type Description
PUBCHEM
120833
Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023
PRIMARY
CAS
901-82-6
Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023
PRIMARY
EPA CompTox
DTXSID501009159
Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023
PRIMARY
FDA UNII
841INQ78E1
Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023
PRIMARY