ETRASIMOD ARGININE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H26F3NO3.C6H14N4O2
Molecular Weight	631.6857
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

N[C@@H](CCCNC(N)=N)C(O)=O.OC(=O)C[C@H]1CCC2=C1NC3=CC=C(OCC4=CC(=C(C=C4)C5CCCC5)C(F)(F)F)C=C23

InChI

InChIKey=GVPVVOSNDUAUKM-BPGOJFKZSA-N

InChI=1S/C26H26F3NO3.C6H14N4O2/c27-26(28,29)22-11-15(5-8-19(22)16-3-1-2-4-16)14-33-18-7-10-23-21(13-18)20-9-6-17(12-24(31)32)25(20)30-23;7-4(5(11)12)2-1-3-10-6(8)9/h5,7-8,10-11,13,16-17,30H,1-4,6,9,12,14H2,(H,31,32);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t17-;4-/m10/s1

HIDE SMILES / InChI

Molecular Formula	C6H14N4O2
Molecular Weight	174.201
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C26H26F3NO3
Molecular Weight	457.4847
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:14:26 UTC 2023` Edited by `admin` on `Sat Dec 16 10:14:26 UTC 2023`
Record UNII	MXE5EMA09L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETRASIMOD ARGININE

Official Name

English

VELSIPITY

Brand Name

English

APD-334 L-ARGININE

Code

English

ETRASIMOD ARGININE [USAN]

Common Name

English

APD334 L-ARGININE

Code

English

L-ARGININE, (3R)-7-((4-CYCLOPENTYL-3-(TRIFLUOROMETHYL)PHENYL)METHOXY)-1,2,3,4-TETRAHYDROCYCLOPENT(B)INDOLE-3-ACETATE (1:1)

Systematic Name

English

L-ARGININE MONO((3R)-7-((4-CYCLOPENTYL-3-(TRIFLUOROMETHYL)PHENYL)METHOXY)-1,2,3,4-TETRAHYDROCYCLOPENTA(B)INDOL-3-YL)ACETATE

Systematic Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

723019