FOSAPREPITANT

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H22F7N4O6P
Molecular Weight	614.4066
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of FOSAPREPITANT

Structure Search

SMILES

C[C@@H](O[C@H]1OCCN(CC2=NN(C(=O)N2)P(O)(O)=O)[C@H]1C3=CC=C(F)C=C3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChIKey=BARDROPHSZEBKC-OITMNORJSA-N

InChI=1S/C23H22F7N4O6P/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)40-20-19(13-2-4-17(24)5-3-13)33(6-7-39-20)11-18-31-21(35)34(32-18)41(36,37)38/h2-5,8-10,12,19-20H,6-7,11H2,1H3,(H,31,32,35)(H2,36,37,38)/t12-,19+,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H22F7N4O6P
Molecular Weight	614.4066
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:26:00 UTC 2023` Edited by `admin` on `Sat Dec 16 16:26:00 UTC 2023`
Record UNII	6L8OF9XRDC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FOSAPREPITANT

Official Name

English

PHOSPHONIC ACID, (3-(((2R,3S)-2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)-4-MORPHOLINYL)METHYL)-4,5-DIHYDRO-5-OXO-1H-1,2,4-TRIAZOL-1-YL)-

Common Name

English

FOSAPREPITANT [MART.]

Common Name

English

FOSAPREPITANT [MI]

Common Name

English

fosaprepitant [INN]

Common Name

English

FOSAPREPITANT [EMA EPAR]

Common Name

English

Fosaprepitant [WHO-DD]

Common Name

English

L-758298

Code

English

FOSAPREPITANT [VANDF]

Common Name

English

(3-(((2R,3S)-2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)MORPHOLIN-4-YL)METHYL)-5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL)PHOSPHONIC ACID

Systematic Name

English

Classification Tree Code System Code

NDF-RT

N0000175786

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

EMA ASSESSMENT REPORTS

IVEMEND (AUTHORIZED: CANCER, VOMITING)

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

NDF-RT

N0000010262

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

NCI_THESAURUS

C267

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

LIVERTOX

437

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

Code System Code Type Description

NCI_THESAURUS

C72787

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

PUBCHEM

135413538

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

DAILYMED

6L8OF9XRDC

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

CAS

172673-20-0

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

ChEMBL

CHEMBL1199324

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

CHEBI

64321

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

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SMS_ID

100000089381

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

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EPA CompTox

DTXSID80102165

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

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WIKIPEDIA

FOSAPREPITANT

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

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DRUG CENTRAL

4470

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

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DRUG BANK

DB06717

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

MESH

C114556

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

RXCUI

1731071

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

IUPHAR

7623

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

INN

8699

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

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FDA UNII

6L8OF9XRDC

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

EVMPD

SUB25384

Created by admin on Sat Dec 16 16:26:01 UTC 2023 , Edited by admin on Sat Dec 16 16:26:01 UTC 2023

PRIMARY

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