(6S,9R,12R,15S,18S,30S)-33-[(1R,2R,4E)-1,6-二羟基-2-甲基己-4-烯-1-基]-30-乙基-1,4,7,10,12,15,19,25,28-九甲基-3,21-二(1-甲基乙基)-6,9,18,24-四(2-甲基丙基)-1,4,7,10,13,16,19,22,25,28,31-十一氮杂环三三十烷-2,5,8,11,14,17,20

pro_cas
89270-28-0
pro_cdbregno
CCD08057637
pro_formula
C62 H111 N11 O13
pro_molWeight
1218.62

basic_info

Product_Name: (6S,9R,12R,15S,18S,30S)-33-[(1R,2R,4E)-1,6-二羟基-2-甲基己-4-烯-1-基]-30-乙基-1,4,7,10,12,15,19,25,28-九甲基-3,21-二(1-甲基乙基)-6,9,18,24-四(2-甲基丙基)-1,4,7,10,13,16,19,22,25,28,31-十一氮杂环三三十烷-2,5,8,11,14,17,20
CAS: 89270-28-0
中文同义词: (6S,9R,12R,15S,18S,30S)-33-[(1R,2R,4E)-1,6-二羟基-2-甲基己-4-烯-1-基]-30-乙基-1,4,7,10,12,15,19,25,28-九甲基-3,21-二(1-甲基乙基)-6,9,18,24-四(2-甲基丙基)-1,4,7,10,13,16,19,22,25,28,31-十一氮杂环三三十烷-2,5,8,11,14,17,20
EnglishSynonyms: CYCLOSPORIN AM 1
pro_mdlNumber: MFCD00870454
pro_acceptors: 24
pro_donors: 6
pro_smile: CC[C@H]1C(=O)N(CC(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1)[C@@H]([C@H](C)C/C=C/CO)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C
InChi: InChI=1S/C62H111N11O13/c1-24-43-58(82)67(17)33-48(75)68(18)44(29-34(2)3)55(79)66-49(38(10)11)61(85)69(19)45(30-35(4)5)54(78)63-41(15)53(77)64-42(16)57(81)70(20)46(31-36(6)7)59(83)71(21)47(32-37(8)9)60(84)72(22)50(39(12)13)62(86)73(23)51(56(80)65-43)52(76)40(14)27-25-26-28-74/h25-26,34-47,49-52,74,76H,24,27-33H2,1-23H3,(H,63,78)(H,64,77)(H,65,80)(H,66,79)/b26-25+/t40-,41+,42-,43+,44+,45+,46+,47+,49+,50+,51+,52-/m1/s1
InChiKey: InChIKey=ZPZHKIOMBYYVRD-WRDPQARASA-N

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