트리코삭타이드
Tricosactide
기본 정보
- CAS
20282-58-0- 표준 SMILES
CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)C(C)C)C(C)C)C(C)C- InChIKey
OGFPDRDMMGEFOE-VELINFEKSA-N- 분자식
- C131H204N40O29S
- 평균 분자량
- 2,835.3 g/mol
- 단동위원소 질량
- 2,833.5438618
이름 및 식별자
- 우선 이름
- Tricosactide
- IUPAC
- (4S)-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-6-amino-1-[(2S)-2-[[(2S)-1-[[2-[[(2S)-6-amino-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-5-carbamimidamido-1-oxopentan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylsulfanylbutanoyl]amino]-5-oxopentanoic acid
- 현지명
- 트리코삭타이드
- 영어명
- Tricosactide
- 분자식
- C131H204N40O29S
- 분자량
- 2835.38
이름 및 동의어
TricosactideTricosactide [INN]tricosactidaUNII-6SPG848M4D6SPG848M4D20282-58-0DTXSID10174140HOE-254tricosactidumRefChem:191374DTXCID6096631ALPHA1-23-CORTICOTROPIN, 23-L-TYROSINAMIDE-
이름 더 보기
트리코삭타이드23-L-Tyrosinamide-α1-23-corticotropinα1-23-Corticotropin, 23-L-tyrosinamide- (8CI,9CI)L-Ser-L-Tyr-L-Ser-L-Met-L-Glu-L-His-L-Phe-L-Arg-L-Trp-Gly-L-Lys-L-Pro-L-Val-Gly-L-Lys-L-Lys-L-Arg-L-Arg-L-Pro-L-Val-L-Lys-L-Val-L-Tyr-NH2
.ALPHA.1-23-CORTICOTROPIN, 23-L-TYROSINAMIDE-TYROSINAMIDE, L-SERYL-L-TYROSYL-L-SERYL-L-METHIONYL-L-GLUTAMYL-L-HISTIDYL-L-PHENYLALANYL-L-ARGINYL-L-TRYPTOPHYLGLYCYL-L-LYSYL-L-PROLYL-L-VALYLGLYCYL-L-LYSYL-L-LYSYL-L-ARGINYL-L-ARGINYL-L-PROLYL-L-VALYL-L-LYSYL-L-VALYL-, L-23-L-Tyrosinamide-alpha(sup 1-23)-corticotropinCHEMBL2103923NS00124024L-Seryl-L-tyrosyl-L-seryl-L-methionyl-L-alpha-glutamyl-L-histidyl-L-phenylalanyl-L-arginyl-L-tryptophylglycyl-L-lysyl-L-prolyl-L-valylglycyl-L-lysyl-L-lysyl-L-arginyl-L-arginyl-L-prolyl-L-valyl-L-lysyl-L-valyl-L-tyrosinamide
물성
구조 계산 물성
- XLogP
- -6.4
- 극성 표면적
- 1,170 Ų
- 수소 결합 공여자 수
- 42
- 수소 결합 수용자 수
- 39
- 회전 가능 결합 수
- 95
- 무거운 원자 수
- 201
- 형식 전하
- 0
- 복잡도
- 6,200
물리화학적 성질
- 밀도
- 1.47 · 1.47±0.1 g/cm3(Predicted)
관련 반응
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