기본 정보
- CAS
125228-51-5- 표준 SMILES
CCC(C)CC1CCC(O)(C(C)(O)C(=O)NC2C(=O)N3NCCCC3C(=O)N(O)C(C)C(=O)NCC(=O)N3NCCCC3C(=O)N(O)C(C)C(=O)OC2C(C)C)OC1C- InChIKey
ZJZOPNINWIGNQW-UHFFFAOYSA-N- 분자식
- C38H64N8O13
- 평균 분자량
- 841 g/mol
- 단동위원소 질량
- 840.45928411
개요
L 156602 is a cyclodepsipeptide.
이름 및 식별자
- 우선 이름
- PD 124966
- IUPAC
- N-(7,21-dihydroxy-6,20-dimethyl-2,5,8,15,19,22-hexaoxo-17-propan-2-yl-18-oxa-1,4,7,13,14,21,27-heptazatricyclo[21.4.0.09,14]heptacosan-16-yl)-2-hydroxy-2-[2-hydroxy-6-methyl-5-(2-methylbutyl)oxan-2-yl]propanamide
- 영어명
- L 156602
- 분자식
- C38H64N8O13
- 분자량
- 840.96
이름 및 동의어
PD 124966PD-124966RefChem:928659107231-21-0125228-51-5N-(7,21-Dihydroxy-6,20-dimethyl-2,5,8,15,19,22-hexaoxo-17-propan-2-yl-18-oxa-1,4,7,13,14,21,27-heptazatricyclo[21.4.0.09,14]heptacosan-16-yl)-2-hydroxy-2-[2-hydroxy-6-methyl-5-(2-methylbutyl)oxan-2-yl]propanamideorb1692182SCHEMBL1569330CHEBI:201537DTXSID201365425AKOS040756308DA-54729
이름 더 보기
Antibiotic L 16602Antibiotic L 156602ZJZOPNINWIGNQW-UHFFFAOYSA-N3-{7-[(2-{[(octadecylcarbamoyl)oxy]methyl}prop-2-en-1-yl)oxy]-7-oxoheptyl}-1,3-thiazol-3-ium bromideD-Alanine, (3S)-3-hydroxy-N-[(2S)-2-hydroxy-1-oxo-2-[(2R,5R,6R)-tetrahydro-2-hydroxy-6-methyl-5-[(2S)-2-methylbutyl]-2H-pyran-2-yl]propyl]-L-leucyl-(3R)-hexahydro-3-pyridazinecarbonyl-N-hydroxy-L-alanylglycyl-(3S)-hexahydro-3-pyridazinecarbonyl-N-hydroxy-, (6→13)-lactone
l156602T38244D-Alanine, (3S)-3-hydroxy-N-[(2S)-2-hydroxy-1-oxo-2-[(2R,5R,6R)-tetrahydro-2-hydroxy-6-methyl-5-[(2S)-2-methylbutyl]-2H-pyran-2-yl]propyl]-L-leucyl-(3R)-hexahydro-3-pyridazinecarbonyl-N-hydroxy-L-alanylglycyl-(3S)-hexahydro-3-pyridazinecarbonyl-N-hydroxy-, (6a13)-lactone
데이터베이스 식별자
- CAS
125228-51-5- PubChem CID
- 164201
- DTXSID
DTXSID201365425- ChEBI
CHEBI:201537
물성
구조 계산 물성
- XLogP
- 1.2
- 극성 표면적
- 280 Ų
- 수소 결합 공여자 수
- 8
- 수소 결합 수용자 수
- 15
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 59
- 형식 전하
- 0
- 복잡도
- 1,590
물리화학적 성질
- 밀도
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- 저장 조건
- -20 °C · Store at -20°C
- 용해도
- DMF: soluble; DMSO: soluble; Ethanol: soluble
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 8.47 · 8.47±0.70(Predicted)
화학 및 산업
공급사10 곳
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
ChemeGen 中国18818260767 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…