ASP-THR-GLY-HIS-SER-ASN-GLN-VAL-SER-GLN-ASN-TYR

pro_cas
pro_cdbregno
CCD00118426
pro_formula
C54 H80 N18 O23
pro_molWeight
1349.33

basic_info

Product_Name: ASP-THR-GLY-HIS-SER-ASN-GLN-VAL-SER-GLN-ASN-TYR
EnglishSynonyms: GAG P17 MA (121-132) ; ASP-THR-GLY-HIS-SER-ASN-GLN-VAL-SER-GLN-ASN-TYR ; P18 (121-132)
pro_mdlNumber: MFCD00273725
pro_acceptors: 41
pro_donors: 23
pro_smile: CC(C)[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(=O)O)N
InChi: InChI=1S/C54H80N18O23/c1-22(2)42(53(93)70-35(20-74)50(90)65-28(8-10-36(56)77)45(85)66-32(16-39(59)80)49(89)68-33(54(94)95)12-24-4-6-26(76)7-5-24)71-46(86)29(9-11-37(57)78)64-48(88)31(15-38(58)79)67-51(91)34(19-73)69-47(87)30(13-25-17-60-21-62-25)63-40(81)18-61-52(92)43(23(3)75)72-44(84)27(55)14-41(82)83/h4-7,17,21-23,27-35,42-43,73-76H,8-16,18-20,55H2,1-3H3,(H2,56,77)(H2,57,78)(H2,58,79)(H2,59,80)(H,60,62)(H,61,92)(H,63,81)(H,64,88)(H,65,90)(H,66,85)(H,67,91)(H,68,89)(H,69,87)(H,70,93)(H,71,86)(H,72,84)(H,82,83)(H,94,95)/t23-,27+,28+,29+,30+,31+,32+,33+,34+,35+,42+,43+/m1/s1
InChiKey: InChIKey=QCHUVUYZYBSAPN-FVBISLOESA-N

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