FLSLIPHAINAVSAIAKHN

CAS号
CCD编号
CCD04011672
分子式
C93 H150 N26 O24
分子量
2016.37

基本信息

产品名称: FLSLIPHAINAVSAIAKHN
英文同义词: PS-2 ; FLSLIPHAINAVSAIAKHN ; PHYLLOSEPTIN-1 ; PHYLLOSEPTIN-2 ; PSN-10 ; PSN-8 ; PSN-2 ; PSN-3 ; PSN-9 ; PSN-1
MDL号: MFCD18252028
氢键受体数量: 50
氢键供体数量: 26
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]3CCCN3C(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc4ccccc4)N
InChi: InChI=1S/C93H150N26O24/c1-17-48(10)72(90(139)105-51(13)75(124)106-59(28-23-24-30-94)80(129)109-63(36-57-40-99-44-101-57)84(133)112-65(93(142)143)38-70(97)123)116-78(127)54(16)104-86(135)66(41-120)114-89(138)71(47(8)9)115-76(125)52(14)103-82(131)64(37-69(96)122)111-91(140)73(49(11)18-2)117-77(126)53(15)102-81(130)62(35-56-39-98-43-100-56)110-88(137)68-29-25-31-119(68)92(141)74(50(12)19-3)118-85(134)61(33-46(6)7)108-87(136)67(42-121)113-83(132)60(32-45(4)5)107-79(128)58(95)34-55-26-21-20-22-27-55/h20-22,26-27,39-40,43-54,58-68,71-74,120-121H,17-19,23-25,28-38,41-42,94-95H2,1-16H3,(H2,96,122)(H2,97,123)(H,98,100)(H,99,101)(H,102,130)(H,103,131)(H,104,135)(H,105,139)(H,106,124)(H,107,128)(H,108,136)(H,109,129)(H,110,137)(H,111,140)(H,112,133)(H,113,132)(H,114,138)(H,115,125)(H,116,127)(H,117,126)(H,118,134)(H,142,143)/t48-,49-,50-,51-,52-,53-,54-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,71-,72-,73-,74-/m0/s1
InChiKey: InChIKey=HAAVFIDZCRXTJD-ASFLVNMFSA-N

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