기본 정보
- 표준 SMILES
COC(=O)[C@@H](CNC(=O)c1ccccc1)[C@@H](C)O- InChIKey
ATBIFOORFZTUKF-KOLCDFICSA-N- 분자식
- C13H17NO4
- 평균 분자량
- 251.28 g/mol
이름 및 식별자
- 우선 이름
- (2S,3R)-methyl-2-benzamidomethyl-3-hydroxybutyrate
- IUPAC
- methyl (2S,3R)-2-(benzamidomethyl)-3-hydroxybutanoate
이름 및 동의어
(2S,3R)-methyl-2-benzamidomethyl-3-hydroxybutyrate124044-13-9SCHEMBL1143555methyl (2S,3R)-2-(benzamidomethyl)-3-hydroxybutanoateATBIFOORFZTUKF-KOLCDFICSA-N(25,3R)-methyl-2-benzamidomethyl-3-hydroxybutyratemethyl (2S,3R)-2-benzamidomethyl-3-hydroxybutyrate(2S, 3R)-methyl-2-benzamidomethyl-3-hydroxybutyratemethyl (2s,3r)-2-(benzamidomethyl)-3-hydroxybutyratemethyl (2S,3R)-2-benzamidomethyl-3-hydroxybutanoatemethyl (2S,3R)-2-(N-benzoylamino)methyl-3-hydroxybutyratemethyl (2S,3R)-2-(N-bezoylaminomethy)-3-hydroxybutyrate
이름 더 보기
methyl (2S, 3R)-2-(N-benzoylamino)methyl-3-hydroxybutanoatemethyl (2S,3R)-2-(N-benzoyl amino)methyl-3-hydroxybutyratemethyl (2S,3R)-2-[(N-benzoylamino)-methyl]-3-hydroxybutyrate
데이터베이스 식별자
- PubChem CID
- 10060699
- Nikkaji
- J595.657I
물성
구조 계산 물성
- XLogP
- 0.8
- 극성 표면적
- 75.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 287
관련 반응
20건
화합물 노트
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