기본 정보
- CAS
1220414-32-3- 표준 SMILES
CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O- InChIKey
KYBIXLAEQWVFTF-XVMJHDPBSA-N- 분자식
- C77H131N27O21S2
- 평균 분자량
- 1,835.2 g/mol
- 단동위원소 질량
- 1,833.94542664
이름 및 식별자
- 우선 이름
- Wilms tumor protein (435-449)
- IUPAC
- (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]amino]-4-oxobutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-5-oxopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-oxobutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-4-methylpentanoic acid
이름 및 동의어
UNII-99B3V6HW3D99B3V6HW3DWilms tumor protein (435-449)His-Asn-Met-His-Gln-Arg-Asn-Met-Thr-Lys-Leu-Gln-Leu-Ala-Leu1220414-32-3L-Histidyl-L-asparaginyl-L-methionyl-L-histidyl-L-glutaminyl-L-arginyl-L-asparaginyl-L-methionyl-L-threonyl-L-lysyl-L-leucyl-L-glutaminyl-L-leucyl-L-alanyl-L-leucineL-Leucine, L-histidyl-L-asparaginyl-L-methionyl-L-histidyl-L-glutaminyl-L-arginyl-L-asparaginyl-L-methionyl-L-threonyl-L-lysyl-L-leucyl-L-glutaminyl-L-leucyl-L-alanyl-
데이터베이스 식별자
- CAS
1220414-32-3- PubChem CID
- 164512950
물성
구조 계산 물성
- XLogP
- -8.8
- 극성 표면적
- 859 Ų
- 수소 결합 공여자 수
- 27
- 수소 결합 수용자 수
- 28
- 회전 가능 결합 수
- 65
- 무거운 원자 수
- 127
- 형식 전하
- 0
- 복잡도
- 3,710
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