tert-butyl 5-[2-[1(RS)-[[N-[(9-fluorenyl)methoxycarbonyl]-L-leucyl]amino]propyl]-4(RS),5,5-trimethyl-1,3,2-dioxaborolan-4-yl]-3(RS)-methylvalerate

HCID 22942158

기본 정보

표준 SMILES
CCC(NC(=O)[C@H](CC(C)C)NC(=O)OCC1c2ccccc2-c2ccccc21)B1OC(C)(C)C(C)(CCC(C)CC(=O)OC(C)(C)C)O1
InChIKey
JIJNLLGXICCBNA-ICBGJNHXSA-N
분자식
C39H57BN2O7
평균 분자량
676.7 g/mol
단동위원소 질량
676.4258823

이름 및 식별자

우선 이름
tert-butyl 5-[2-[1(RS)-[[N-[(9-fluorenyl)methoxycarbonyl]-L-leucyl]amino]propyl]-4(RS),5,5-trimethyl-1,3,2-dioxaborolan-4-yl]-3(RS)-methylvalerate
IUPAC
tert-butyl 5-[2-[1-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoyl]amino]propyl]-4,5,5-trimethyl-1,3,2-dioxaborolan-4-yl]-3-methylpentanoate

이름 및 동의어

SCHEMBL7417280JIJNLLGXICCBNA-ICBGJNHXSA-Ntert-butyl 5-[2-[1(RS)-[[N-[(9-fluorenyl)methoxycarbonyl]-L-leucyl]amino]propyl]-4(RS) ,5,5-trimethyl-1,3,2-dioxaborolan-4-yl]-3(RS)-methylvaleratetert-butyl 5-[2-[1(RS)-[[N-[(9-fluorenyl)methoxycarbonyl]-L-leucyl]amino]propyl]-4(RS),5,5-trimethyl-1,3,2-dioxaborolan-4-yl]-3(RS)-methylvalerate

데이터베이스 식별자

PubChem CID
22942158
Nikkaji
J1.357.432D

물성

구조 계산 물성

극성 표면적
112 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
7
회전 가능 결합 수
17
무거운 원자 수
49

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4건

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