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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H34O5.C14H22ClN3O2
Molecular Weight 702.32
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METOCLOPRAMIDE DEHYDROCHOLATE

SMILES

CCN(CC)CCNC(=O)C1=C(OC)C=C(N)C(Cl)=C1.[H][C@@]23CC[C@H]([C@H](C)CCC(O)=O)[C@@]2(C)C(=O)C[C@@]4([H])[C@@]3([H])C(=O)C[C@]5([H])CC(=O)CC[C@]45C

InChI

InChIKey=ZKQXEPHBYKAFLH-CAOXKPNISA-N
InChI=1S/C24H34O5.C14H22ClN3O2/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29);8-9H,4-7,16H2,1-3H3,(H,17,19)/t13-,14+,16-,17+,18+,22+,23+,24-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
METOCLOPRAMIDE DEHYDROCHOLATE
Common Name English
Metoclopramide dehydrocholate [WHO-DD]
Common Name English
Code System Code Type Description
FDA UNII
L3KU3D98YX
Created by admin on Sat Dec 16 13:54:37 UTC 2023 , Edited by admin on Sat Dec 16 13:54:37 UTC 2023
PRIMARY
PUBCHEM
139593517
Created by admin on Sat Dec 16 13:54:37 UTC 2023 , Edited by admin on Sat Dec 16 13:54:37 UTC 2023
PRIMARY