GLU-THR-PRO-ASP-CYS-PHE-TRP-LYS-TYR-CYS-VAL (HYDROCHLORIDE FORM)

CAS号
251293-28-4
CCD编号
CCD00332139
分子式
C64H88ClN13O18S2
分子量
1427.06

基本信息

产品名称: GLU-THR-PRO-ASP-CYS-PHE-TRP-LYS-TYR-CYS-VAL (HYDROCHLORIDE FORM)
CAS: 251293-28-4
英文同义词: UROTENSIN II (HUMAN) (HYDROCHLORIDE FORM) ; GLU-THR-PRO-ASP-CYS-PHE-TRP-LYS-TYR-CYS-VAL (HYDROCHLORIDE FORM)
MDL号: MFCD02684277
氢键受体数量: 31
氢键供体数量: 17
Smile: Cl.CC(C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CS)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)[C@@H](C)O)C(O)=O
InChi: InChI=1S/C64H87N13O18S2.ClH/c1-33(2)52(64(94)95)75-61(91)48(32-97)74-57(87)44(27-36-18-20-38(79)21-19-36)69-55(85)42(16-9-10-24-65)68-58(88)45(28-37-30-67-41-15-8-7-14-39(37)41)71-56(86)43(26-35-12-5-4-6-13-35)70-60(90)47(31-96)73-59(89)46(29-51(82)83)72-62(92)49-17-11-25-77(49)63(93)53(34(3)78)76-54(84)40(66)22-23-50(80)81;/h4-8,12-15,18-21,30,33-34,40,42-49,52-53,67,78-79,96-97H,9-11,16-17,22-29,31-32,65-66H2,1-3H3,(H,68,88)(H,69,85)(H,70,90)(H,71,86)(H,72,92)(H,73,89)(H,74,87)(H,75,91)(H,76,84)(H,80,81)(H,82,83)(H,94,95);1H/t34-,40+,42+,43+,44+,45+,46+,47+,48+,49+,52+,53+;/m1./s1
InChiKey: InChIKey=HVWTXVHJXKYZMD-SWXJRECRSA-N

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