Fosrolapitant

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H29F6N2O8P
Molecular Weight	654.4919
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H](OC[C@]1(CC[C@]2(CCC(=O)N2)CN1C(=O)OCOP(O)(O)=O)C3=CC=CC=C3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChIKey=PKXQGSOAMISYFP-LJXNEXSDSA-N

InChI=1S/C27H29F6N2O8P/c1-17(18-11-20(26(28,29)30)13-21(12-18)27(31,32)33)41-15-25(19-5-3-2-4-6-19)10-9-24(8-7-22(36)34-24)14-35(25)23(37)42-16-43-44(38,39)40/h2-6,11-13,17H,7-10,14-16H2,1H3,(H,34,36)(H2,38,39,40)/t17-,24-,25-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H29F6N2O8P
Molecular Weight	654.4919
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 `Wed Apr 02 20:56:45 GMT 2025` Edited by `admin` on `Wed Apr 02 20:56:45 GMT 2025`
Record UNII	M5QGY92X8B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

fosrolapitant [INN]

Preferred Name

English

Fosrolapitant

Official Name

English

(Phosphonooxy)methyl (5S,8S)-8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-2-oxo-8-phenyl-1,7-diazaspiro[4.5]decane-7-carboxylate

Systematic Name

English

1,7-Diazaspiro[4.5]decane-7-carboxylic acid, 8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-2-oxo-8-phenyl-, (phosphonooxy)methyl ester, (5S,8S)-

Systematic Name

English

Code System Code Type Description

INN

13283