(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-((S)-2,6-dioxohexahydropyrimidine-4-carboxamido)phenyl)propanoic acid

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H26N4O7
Molecular Weight	542.5393
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-((S)-2,6-dioxohexahydropyrimidine-4-carboxamido)phenyl)propanoic acid

Structure Search

SMILES

OC(=O)[C@H](CC1=CC=C(NC(=O)[C@@H]2CC(=O)NC(=O)N2)C=C1)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChIKey=TYZSMQUWFLKJFB-ZEQRLZLVSA-N

InChI=1S/C29H26N4O7/c34-25-14-23(31-28(38)33-25)26(35)30-17-11-9-16(10-12-17)13-24(27(36)37)32-29(39)40-15-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-12,22-24H,13-15H2,(H,30,35)(H,32,39)(H,36,37)(H2,31,33,34,38)/t23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H26N4O7
Molecular Weight	542.5393
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:54:35 GMT 2023` Edited by `admin` on `Sat Dec 16 19:54:35 GMT 2023`
Record UNII	HE42899KS3
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-((S)-2,6-dioxohexahydropyrimidine-4-carboxamido)phenyl)propanoic acid

Systematic Name

English

Fmoc-Aph(Hor)-OH

Common Name

English

Fmoc-L-Aph(L-Hor)-OH

Common Name

English

L-Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-[[[(4S)-hexahydro-2,6-dioxo-4-pyrimidinyl]carbonyl]amino]-

Systematic Name

English

N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-4-[[[(4S)-hexahydro-2,6-dioxo-4-pyrimidinyl]carbonyl]amino]-L-phenylalanine

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID00857011

Created by admin on Sat Dec 16 19:54:35 GMT 2023 , Edited by admin on Sat Dec 16 19:54:35 GMT 2023

PRIMARY

PUBCHEM

71721449

Created by admin on Sat Dec 16 19:54:35 GMT 2023 , Edited by admin on Sat Dec 16 19:54:35 GMT 2023

PRIMARY

FDA UNII

HE42899KS3

Created by admin on Sat Dec 16 19:54:35 GMT 2023 , Edited by admin on Sat Dec 16 19:54:35 GMT 2023

PRIMARY

CAS

1253282-31-3

Created by admin on Sat Dec 16 19:54:35 GMT 2023 , Edited by admin on Sat Dec 16 19:54:35 GMT 2023

PRIMARY