basic_info |
|
| Product_Name： | H-GLN-ASP-GLU-GLY-GLN-GLU-SER-LEU-GLU-GLU-GLU-LEU-ASP-VAL-LEU-VAL-LEU-ASP-ASP-GLU-GLY-GLY-GLN-VAL-SER-TYR-PRO-SER-MET-OH |
| EnglishSynonyms： | H-GLN-ASP-GLU-GLY-GLN-GLU-SER-LEU-GLU-GLU-GLU-LEU-ASP-VAL-LEU-VAL-LEU-ASP-ASP-GLU-GLY-GLY-GLN-VAL-SER-TYR-PRO-SER-MET-OH ; QDEGQESLEEELDVLVLDDEGGQVSYPSM ; P120CTN, HUMAN |
| pro_mdlNumber： | MFCD11113572 |
| pro_acceptors： | 89 |
| pro_donors： | 46 |
| pro_smile： | CC(C)C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCSC)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)N)N |
| InChi： | InChI=1S/C135H210N32O57S/c1-59(2)44-78(154-128(216)87(56-168)161-117(205)76(32-41-102(188)189)147-113(201)71(25-34-92(138)173)143-96(177)55-142-112(200)70(28-37-98(180)181)145-122(210)82(49-103(190)191)152-110(198)68(136)24-33-91(137)172)119(207)150-74(30-39-100(184)185)115(203)148-73(29-38-99(182)183)114(202)149-75(31-40-101(186)187)116(204)153-79(45-60(3)4)120(208)157-85(52-106(196)197)126(214)166-108(64(11)12)132(220)159-81(47-62(7)8)125(213)165-107(63(9)10)131(219)158-80(46-61(5)6)121(209)155-84(51-105(194)195)124(212)156-83(50-104(192)193)123(211)146-69(27-36-97(178)179)111(199)141-53-94(175)140-54-95(176)144-72(26-35-93(139)174)118(206)164-109(65(13)14)133(221)163-89(58-170)129(217)160-86(48-66-20-22-67(171)23-21-66)134(222)167-42-16-19-90(167)130(218)162-88(57-169)127(215)151-77(135(223)224)18-17-43-225-15/h20-23,59-65,68-90,107-109,168-171H,16-19,24-58,136H2,1-15H3,(H2,137,172)(H2,138,173)(H2,139,174)(H,140,175)(H,141,199)(H,142,200)(H,143,177)(H,144,176)(H,145,210)(H,146,211)(H,147,201)(H,148,203)(H,149,202)(H,150,207)(H,151,215)(H,152,198)(H,153,204)(H,154,216)(H,155,209)(H,156,212)(H,157,208)(H,158,219)(H,159,220)(H,160,217)(H,161,205)(H,162,218)(H,163,221)(H,164,206)(H,165,213)(H,166,214)(H,178,179)(H,180,181)(H,182,183)(H,184,185)(H,186,187)(H,188,189)(H,190,191)(H,192,193)(H,194,195)(H,196,197)(H,223,224)/t68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,107-,108-,109+/m0/s1 |
| InChiKey： | InChIKey=MXXITKBDFNXPPJ-SWWPWLOPSA-N |
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