A-792611

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C47H60N6O6
Molecular Weight	805.0159
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)N[C@H](C(=O)N[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](N2CCN(CC3=CC=CC=C3)C2=O)C(C)(C)C)CC4=CC=C(C=C4)C5=NC=CC=C5)C(C)(C)C

InChI

InChIKey=KMAMPFGXPHTYPQ-KMHPXQNHSA-N

InChI=1S/C47H60N6O6/c1-46(2,3)40(51-44(57)59-7)42(55)49-36(28-33-21-23-35(24-22-33)37-20-14-15-25-48-37)30-39(54)38(29-32-16-10-8-11-17-32)50-43(56)41(47(4,5)6)53-27-26-52(45(53)58)31-34-18-12-9-13-19-34/h8-25,36,38-41,54H,26-31H2,1-7H3,(H,49,55)(H,50,56)(H,51,57)/t36-,38-,39-,40+,41+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C47H60N6O6
Molecular Weight	805.0159
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:33:51 GMT 2025` Edited by `admin` on `Mon Mar 31 23:33:51 GMT 2025`
Record UNII	114L0XB8FM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CARBAMIC ACID, ((1S)-1-((((1S,3S,4S)-4-(((2S)-3,3-DIMETHYL-1-OXO-2-(2-OXO-3-(PHENYLMETHYL)-1-IMIDAZOLIDINYL)BUTYL)AMINO)-3-HYDROXY-5-PHENYL-1-((4-(2-PYRIDINYL)PHENYL)METHYL)PENTYL)AMINO)CARBONYL)-2,2-DIMETHYLPROPYL)-, METHYL ESTER

Preferred Name

English

A-792611

Common Name

English

CARBAMIC ACID, N-((1S)-1-((((1S,3S,4S)-4-(((2S)-3,3-DIMETHYL-1-OXO-2-(2-OXO-3-(PHENYLMETHYL)-1-IMIDAZOLIDINYL)BUTYL)AMINO)-3-HYDROXY-5-PHENYL-1-((4-(2-PYRIDINYL)PHENYL)METHYL)PENTYL)AMINO)CARBONYL)-2,2-DIMETHYLPROPYL)-, METHYL ESTER

Systematic Name

English

Code System Code Type Description

PUBCHEM

11274374

Created by admin on Mon Mar 31 23:33:51 GMT 2025 , Edited by admin on Mon Mar 31 23:33:51 GMT 2025

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CAS

854758-17-1

Created by admin on Mon Mar 31 23:33:51 GMT 2025 , Edited by admin on Mon Mar 31 23:33:51 GMT 2025

PRIMARY

FDA UNII

114L0XB8FM

Created by admin on Mon Mar 31 23:33:51 GMT 2025 , Edited by admin on Mon Mar 31 23:33:51 GMT 2025

PRIMARY

Related Record Type Details


					114L0XB8FM

A-792611

ACTIVE MOIETY