LFA-878

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H48N2O7
Molecular Weight	596.7541
Optical Activity	( + )
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12[C@H](C[C@@H](C)C=C1C=C[C@H](C)[C@@H]2CC[C@@H]3C[C@H](CC(=O)NC)N(CC4=CC=C(O)C(OC)=C4)C(=O)O3)OC(=O)[C@@H](C)CC

InChI

InChIKey=XGCZRGJUCNQVCO-XFAJEYMZSA-N

InChI=1S/C34H48N2O7/c1-7-21(3)33(39)43-30-15-20(2)14-24-10-8-22(4)27(32(24)30)12-11-26-17-25(18-31(38)35-5)36(34(40)42-26)19-23-9-13-28(37)29(16-23)41-6/h8-10,13-14,16,20-22,25-27,30,32,37H,7,11-12,15,17-19H2,1-6H3,(H,35,38)/t20-,21-,22-,25+,26+,27-,30-,32-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C34H48N2O7
Molecular Weight	596.7541
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:48:14 GMT 2023` Edited by `admin` on `Sat Dec 16 10:48:14 GMT 2023`
Record UNII	ZN9WFS3G4L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LFA-878

Code

English

(1S,3R,7S,8S,8AR)-1,2,3,7,8,8A-HEXAHYDRO-3,7-DIMETHYL-8-(2-((4R,6R)-TETRAHYDRO-3-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-4-(2-(METHYLAMINO)-2-OXOETHYL)-2-OXO-2H-1,3-OXAZIN-6-YL)ETHYL)-1-NAPHTHALENYL (2S)-2-METHYLBUTANOATE

Systematic Name

English

(1S,3R,7S,8S,8AR)-8-(2-((4R,6R)-3-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-4-((METHYLCARBAMOYL)METHYL)-2-OXO-1,3-OXAZINAN-6-YL)ETHYL)-3,7-DIMETHYL-1,2,3,7,8,8A-HEXAHYDRONAPHTHALEN-1-YL (2S)-2-METHYLBUTANOATE

Systematic Name

English

LFA878

Code

English

BUTANOIC ACID, 2-METHYL-, (1S,3R,7S,8S,8AR)-1,2,3,7,8,8A-HEXAHYDRO-3,7-DIMETHYL-8-(2-((4R,6R)-TETRAHYDRO-3-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-4-(2-(METHYLAMINO)-2-OXOETHYL)-2-OXO-2H-1,3-OXAZIN-6-YL)ETHYL)-1-NAPHTHALENYL ESTER, (2S)-

Systematic Name

English

(+)-LFA-878

Common Name

English

Code System Code Type Description

FDA UNII

ZN9WFS3G4L

Created by admin on Sat Dec 16 10:48:14 GMT 2023 , Edited by admin on Sat Dec 16 10:48:14 GMT 2023

PRIMARY

CAS

288323-75-1

Created by admin on Sat Dec 16 10:48:14 GMT 2023 , Edited by admin on Sat Dec 16 10:48:14 GMT 2023

PRIMARY

PUBCHEM

449170

Created by admin on Sat Dec 16 10:48:14 GMT 2023 , Edited by admin on Sat Dec 16 10:48:14 GMT 2023

PRIMARY

Related Record Type Details


					ZN9WFS3G4L

LFA-878

ACTIVE MOIETY