DERSIMELAGON PHOSPHATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H45F4N3O5.H3O4P
Molecular Weight	773.7484
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OP(O)(O)=O.COC[C@H]1CN(C[C@@H]1C2=C(C=C(C=C2)C(F)(F)F)N3CCC(CC3)C(O)=O)C(=O)[C@]4(F)CN(C[C@H]4C5=CC=C(OC)C=C5)C6CCCC6

InChI

InChIKey=PICGAOGKGDTMCU-ZPNFXMDPSA-N

InChI=1S/C36H45F4N3O5.H3O4P/c1-47-21-25-18-42(19-30(25)29-12-9-26(36(38,39)40)17-32(29)41-15-13-24(14-16-41)33(44)45)34(46)35(37)22-43(27-5-3-4-6-27)20-31(35)23-7-10-28(48-2)11-8-23;1-5(2,3)4/h7-12,17,24-25,27,30-31H,3-6,13-16,18-22H2,1-2H3,(H,44,45);(H3,1,2,3,4)/t25-,30+,31+,35+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	H3O4P
Molecular Weight	97.9952
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C36H45F4N3O5
Molecular Weight	675.7532
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:13:19 GMT 2023` Edited by `admin` on `Sat Dec 16 14:13:19 GMT 2023`
Record UNII	7GHY3N4EDN
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DERSIMELAGON PHOSPHATE

Official Name

English

MT-7117 PHOSPHATE

Code

English

(1-(2-((3S,4R)-1-((3R,4R)-1-CYCLOPENTYL-3-FLUORO-4-(4-METHOXYPHENYL)PYRROLIDINE-3-CARBONYL)-4-(METHOXYMETHYL)PYRROLIDIN-3-YL)-5-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE-4-CARBOXYLIC CIDPHOSPHORIC ACID (1/1))

Systematic Name

English

DERSIMELAGON PHOSPHATE [USAN]

Common Name

English

DERSIMELAGON PHOSPHORIC ACID [JAN]

Common Name

English

DERSIMELAGON PHOSPHORIC ACID

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

645518