GAG P17 MA (78-92) (1)

CAS号
CCD编号
CCD00118331
分子式
C81 H128 N22 O22 S
分子量
1794.1

基本信息

产品名称: GAG P17 MA (78-92) (1)
英文同义词: P18 (78-92) ; LEU-TYR-ASN-THR-VAL-ALA-THR-LEU-TYR-CYS-VAL-HIS-GLN-ARG-ILE ; GAG P17 MA (78-92) (1)
MDL号: MFCD00273629
氢键受体数量: 44
氢键供体数量: 26
Smile: CC[C@H](C)[C@@H](C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](Cc3ccc(cc3)O)NC(=O)[C@H](CC(C)C)N
InChi: InChI=1S/C81H128N22O22S/c1-14-41(10)63(80(124)125)101-69(113)51(16-15-27-88-81(85)86)91-68(112)52(25-26-59(83)108)92-73(117)56(32-47-34-87-36-89-47)97-77(121)62(40(8)9)99-75(119)58(35-126)98-72(116)55(31-46-19-23-49(107)24-20-46)94-70(114)53(29-38(4)5)96-78(122)64(43(12)104)102-66(110)42(11)90-76(120)61(39(6)7)100-79(123)65(44(13)105)103-74(118)57(33-60(84)109)95-71(115)54(30-45-17-21-48(106)22-18-45)93-67(111)50(82)28-37(2)3/h17-24,34,36-44,50-58,61-65,104-107,126H,14-16,25-33,35,82H2,1-13H3,(H2,83,108)(H2,84,109)(H,87,89)(H,90,120)(H,91,112)(H,92,117)(H,93,111)(H,94,114)(H,95,115)(H,96,122)(H,97,121)(H,98,116)(H,99,119)(H,100,123)(H,101,113)(H,102,110)(H,103,118)(H,124,125)(H4,85,86,88)/t41-,42-,43+,44+,50-,51-,52-,53-,54-,55-,56-,57-,58-,61-,62-,63-,64-,65-/m0/s1
InChiKey: InChIKey=ZCTYBIVYDLOJCU-GZHSVQCQSA-N

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