Basic Information |
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Product Name: | P17 GAG (20-28) |
English Synonyms: | P17 GAG (20-28) ; RK9 |
MDL Number.: | MFCD23381254 |
H bond acceptor: | 28 |
H bond donor: | 18 |
Smile: | CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)N |
InChi: | InChI=1S/C45H86N18O10/c1-27(2)24-33(62-37(66)28(49)12-9-21-54-44(50)51)40(69)60-31(16-10-22-55-45(52)53)42(71)63-23-11-17-34(63)41(70)57-25-35(64)56-26-36(65)58-29(13-3-6-18-46)38(67)59-30(14-4-7-19-47)39(68)61-32(43(72)73)15-5-8-20-48/h27-34H,3-26,46-49H2,1-2H3,(H,56,64)(H,57,70)(H,58,65)(H,59,67)(H,60,69)(H,61,68)(H,62,66)(H,72,73)(H4,50,51,54)(H4,52,53,55)/t28-,29-,30-,31-,32-,33-,34+/m0/s1 |
InChiKey: | InChIKey=VSEUIKMUGHPXOO-NNBBAHFXSA-N |
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