Name: type I hair keratin fragment [Homo sapiens]/[Ovis aries]/[Rattus norvegicus]
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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212709478
Cas No:
常用名:type I hair keratin fragment [Homo sapiens]/[Ovis aries]/[Rattus norvegicus]
常用名:type I hair keratin fragment [Homo sapiens]/[Ovis aries]/[Rattus norvegicus]
IUPAC:2-[2-(2-{2-[2-(2-{2-[2-(2-amino-4-methylpentanamido)-3-carbamoylpropanamido]-3-carboxypropanamido}-5-carbamimidamidopentanamido)-4-methylpentanamido]propanamido}-3-hydroxypropanamido)-3-(4-hydroxyphenyl)propanamido]-4-methylpentanoic acid
IUPAC:2-[2-(2-{2-[2-(2-{2-[2-(2-amino-4-methylpentanamido)-3-carbamoylpropanamido]-3-carboxypropanamido}-5-carbamimidamidopentanamido)-4-methylpentanamido]propanamido}-3-hydroxypropanamido)-3-(4-hydroxyphenyl)propanamido]-4-methylpentanoic acid
InChI key:YSYNNTAQMGZRJN-UHFFFAOYSA-N

分子式:C47H77N13O15
分子量:1064.209
氢键供体数 (HBD):17
氢键受体数 (HBA):19
LogP:-7.7127805
SMILES:CC(C)CC(N)C(=O)NC(CC(N)=O)C(=O)NC(CC(O)=O)C(=O)NC(CCCNC(N)=N)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(O)=O
SMILES:CC(C)CC(N)C(=O)NC(CC(N)=O)C(=O)NC(CC(O)=O)C(=O)NC(CCCNC(N)=N)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(O)=O

The human type I hair keratin subfamily comprises nine individual members, which can be subdivided into three groups. Group A (hHa1, hHa3-I, hHa3-II, hHa4) and B (hHa7, hHa8) each contains structurally related hair keratins, whereas group C members hHa2, hHa5, and hHa6 represent structurally rather unrelated hair keratins1.

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