ABBLIS AB1008462_Chemical Cloud Database

ABBLIS AB1008462

Basic Information
Product Name：	ABBLIS AB1008462
English Synonyms：	ABBLIS AB1008462 ; FRAGMENTA CYC142
MDL Number.：	MFCD20926255
H bond acceptor：	13
H bond donor：	4
Smile：	CCCC(C(=O)C(=O)NC1CC1)NC(=O)[C@@H]2[C@H]3CCC[C@H]3CN2C(=O)[C@H](C(C)(C)C)NC(=O)[C@H](C4CCCCC4)NC(=O)c5cnccn5
InChi：	InChI=1S/C36H53N7O6/c1-5-10-25(29(44)34(48)39-23-15-16-23)40-33(47)28-24-14-9-13-22(24)20-43(28)35(49)30(36(2,3)4)42-32(46)27(21-11-7-6-8-12-21)41-31(45)26-19-37-17-18-38-26/h17-19,21-25,27-28,30H,5-16,20H2,1-4H3,(H,39,48)(H,40,47)(H,41,45)(H,42,46)/t22-,24-,25?,27-,28-,30+/m0/s1
InChiKey：	InChIKey=BBAWEDCPNXPBQM-IGSHNTALSA-N

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