METOCLOPRAMIDE DEHYDROCHOLATE

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

Structure Search

SMILES

CCN(CC)CCNC(=O)C1=CC(Cl)=C(N)C=C1OC.C[C@H](CCC(O)=O)[C@H]2CC[C@H]3[C@H]4[C@H](CC(=O)[C@]23C)[C@@]5(C)CCC(=O)C[C@H]5CC4=O

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

Molecular Formula	C24H33O5
Molecular Weight	401.5158
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C14H22ClN3O2
Molecular Weight	299.796
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 `Tue Apr 01 21:40:26 GMT 2025` Edited by `admin` on `Tue Apr 01 21:40:26 GMT 2025`
Record UNII	L3KU3D98YX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METOCLOPRAMIDE DEHYDROCHOLATE

Common Name

English

Metoclopramide dehydrocholate [WHO-DD]

Preferred Name

English

Code System Code Type Description

FDA UNII

L3KU3D98YX

Created by admin on Tue Apr 01 21:40:26 GMT 2025 , Edited by admin on Tue Apr 01 21:40:26 GMT 2025

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PUBCHEM

139593517

Created by admin on Tue Apr 01 21:40:26 GMT 2025 , Edited by admin on Tue Apr 01 21:40:26 GMT 2025

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