NEF (51-62)_Chemical Cloud Database

NEF (51-62)

Basic Information
Product Name：	NEF (51-62)
English Synonyms：	THR-ASN-ALA-ALA-CYS-ALA-TRP-LEU-GLU-ALA-GLN-GLU ; NEF (51-62)
MDL Number.：	MFCD00273696
H bond acceptor：	35
H bond donor：	19
Smile：	CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H]([C@@H](C)O)N
InChi：	InChI=1S/C55H83N15O20S/c1-23(2)18-35(51(85)65-33(13-16-41(74)75)48(82)61-26(5)45(79)64-32(12-15-39(56)72)49(83)66-34(55(89)90)14-17-42(76)77)68-52(86)36(19-29-21-59-31-11-9-8-10-30(29)31)67-46(80)27(6)63-53(87)38(22-91)70-47(81)25(4)60-44(78)24(3)62-50(84)37(20-40(57)73)69-54(88)43(58)28(7)71/h8-11,21,23-28,32-38,43,59,71,91H,12-20,22,58H2,1-7H3,(H2,56,72)(H2,57,73)(H,60,78)(H,61,82)(H,62,84)(H,63,87)(H,64,79)(H,65,85)(H,66,83)(H,67,80)(H,68,86)(H,69,88)(H,70,81)(H,74,75)(H,76,77)(H,89,90)/t24-,25-,26-,27-,28+,32-,33-,34-,35-,36-,37-,38-,43-/m0/s1
InChiKey：	InChIKey=YTIHDTHPAIQVMV-RTFKDMGCSA-N

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