GR 94800

pro_cas
141636-65-9
pro_cdbregno
CCD00179789
pro_formula
C49 H61 N9 O8
pro_molWeight
904.076

basic_info

Product_Name: GR 94800
CAS: 141636-65-9
EnglishSynonyms: GR 94800
pro_mdlNumber: MFCD00911052
pro_acceptors: 17
pro_donors: 7
pro_smile: CC[C@H](C)[C@@H](C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H]2CCCN2C(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H](Cc4c[nH]c5c4cccc5)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)c6ccccc6
InChi: InChI=1S/C49H61N9O8/c1-5-29(2)41(42(50)59)56-47(64)39-22-14-24-57(39)49(66)40-23-15-25-58(40)48(65)38(26-32-16-8-6-9-17-32)55-46(63)37(27-34-28-51-36-21-13-12-20-35(34)36)54-44(61)31(4)52-43(60)30(3)53-45(62)33-18-10-7-11-19-33/h6-13,16-21,28-31,37-41,51H,5,14-15,22-27H2,1-4H3,(H2,50,59)(H,52,60)(H,53,62)(H,54,61)(H,55,63)(H,56,64)/t29-,30-,31-,37+,38-,39-,40+,41-/m0/s1
InChiKey: InChIKey=KIPTYYXCLIQOHM-KKMBCTKYSA-N

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