GP120-W61D-118

CAS号
CCD编号
CCD00416224
分子式
C69 H108 N22 O26 S
分子量
1693.81

基本信息

产品名称: GP120-W61D-118
英文同义词: GP120-W61D-118 ; H-ASN-GLU-THR-GLU-ILE-PHE-ARG-PRO-GLY-GLY-GLY-ASP-MET-ARG-ASP-OH ; NETEIFRPGGGDMRD
MDL号: MFCD03790155
氢键受体数量: 48
氢键供体数量: 27
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N2CCC[C@H]2C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)N)N
InChi: InChI=1S/C69H108N22O26S/c1-5-33(2)54(89-59(108)39(18-20-51(99)100)85-65(114)55(34(3)92)90-60(109)38(17-19-50(97)98)82-56(105)36(70)27-46(71)93)64(113)87-42(26-35-12-7-6-8-13-35)61(110)86-41(15-10-23-77-69(74)75)66(115)91-24-11-16-45(91)63(112)80-31-48(95)78-30-47(94)79-32-49(96)81-43(28-52(101)102)62(111)84-40(21-25-118-4)58(107)83-37(14-9-22-76-68(72)73)57(106)88-44(67(116)117)29-53(103)104/h6-8,12-13,33-34,36-45,54-55,92H,5,9-11,14-32,70H2,1-4H3,(H2,71,93)(H,78,95)(H,79,94)(H,80,112)(H,81,96)(H,82,105)(H,83,107)(H,84,111)(H,85,114)(H,86,110)(H,87,113)(H,88,106)(H,89,108)(H,90,109)(H,97,98)(H,99,100)(H,101,102)(H,103,104)(H,116,117)(H4,72,73,76)(H4,74,75,77)/t33-,34+,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,54-,55-/m0/s1
InChiKey: InChIKey=XVDWJUCYHBNTOV-ORUDGJGWSA-N

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