(Q106574688)

English

2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

group of isomers

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

631.244737 dalton

1 reference

language of work or name

English

title

Efonidipine (English)

retrieved

4 October 2016

chemical formula

C₃₄H₃₈N₃O₇P

1 reference

language of work or name

English

title

Efonidipine (English)

retrieved

19 November 2016

canonical SMILES

CC1=C(C(C(=C(N1)C)P2(=O)OCC(CO2)(C)C)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCN(CC4=CC=CC=C4)C5=CC=CC=C5

1 reference

language of work or name

English

title

Efonidipine (English)

retrieved

19 November 2016

Identifiers

InChI

InChI=1S/C34H38N3O7P/c1-24-30(33(38)42-19-18-36(28-15-9-6-10-16-28)21-26-12-7-5-8-13-26)31(27-14-11-17-29(20-27)37(39)40)32(25(2)35-24)45(41)43-22-34(3,4)23-44-45/h5-17,20,31,35H,18-19,21-23H2,1-4H3

1 reference

language of work or name

English

title

Efonidipine (English)

retrieved

19 November 2016

InChIKey

NSVFSAJIGAJDMR-UHFFFAOYSA-N

1 reference

language of work or name

English

title

Efonidipine (English)

19 November 2016

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

26 December 2021

mapping relation type

exact match

1 reference

stated in

ChEBI release 2021-03-01

Human Metabolome Database ID

HMDB0251715

1 reference

based on heuristic

inferred from InChIKey

Probes And Drugs ID

PD008991

0 references

(Q106574688)

2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

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Identifiers

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