Name: Cortistatin-14 acetate
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT214421687
Cas No:
常用名:Cortistatin-14 acetate
别名:皮质抑素-14醋酸盐, Cortistatin-14 acetate(186901-48-4 Free base)
别名:皮质抑素-14醋酸盐, Cortistatin-14 acetate(186901-48-4 Free base)
IUPAC:(2S)-N-[(4R,7S,10S,13S,16S,19S,22S,25S,28S,31S,34S,37R)-4-{[(1S)-5-amino-1-carbamoylpentyl]carbamoyl}-19,34-bis(4-aminobutyl)-13,25,28-tribenzyl-31-(carbamoylmethyl)-16-[(1R)-1-hydroxyethyl]-7,10-bis(hydroxymethyl)-22-[(1H-indol-3-yl)methyl]-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontan-37-yl]pyrrolidine-2-carboxamide; acetic acid
IUPAC:(2S)-N-[(4R,7S,10S,13S,16S,19S,22S,25S,28S,31S,34S,37R)-4-{[(1S)-5-amino-1-carbamoylpentyl]carbamoyl}-19,34-bis(4-aminobutyl)-13,25,28-tribenzyl-31-(carbamoylmethyl)-16-[(1R)-1-hydroxyethyl]-7,10-bis(hydroxymethyl)-22-[(1H-indol-3-yl)methyl]-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontan-37-yl]pyrrolidine-2-carboxamide; acetic acid
InChI key:XMUDLOHINAFJJP-BJUJOSGCSA-N

分子式:C83H118N20O20S2
分子量:1780.1
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(O)=O.[H][C@]1(NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O
SMILES:CC(O)=O.[H][C@]1(NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O

Cortistatin-14 acetate 是一种与生长抑素-14结构相似的神经肽，通过生长抑素受体 (sst1-sst5) 结合并发挥作用。Cortistatin-14 acetate 具有抗惊厥、神经保护作用和显著的抗炎作用。

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