Free release

OXECLOSPORIN

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Name: OXECLOSPORIN
CAS: 135548-15-1
Synonyms: OXECLOSPORIN
MDL.: MFCD00867598
H bond acceptor: 25
H bond donor: 6
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(C(=O)N1)[C@@H]([C@H](C)C/C=C/C)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)OCCO)C)CCC(C)C)C)C(C)C)CC(C)C)C)C
InChi: InChI=1S/C64H115N11O14/c1-24-26-27-42(15)53(78)52-57(82)66-44(25-2)59(83)69(17)35-49(77)70(18)46(32-37(5)6)56(81)67-50(40(11)12)62(86)71(19)45(29-28-36(3)4)55(80)65-43(16)54(79)68-58(89-31-30-76)64(88)73(21)47(33-38(7)8)60(84)72(20)48(34-39(9)10)61(85)74(22)51(41(13)14)63(87)75(52)23/h24,26,36-48,50-53,58,76,78H,25,27-35H2,1-23H3,(H,65,80)(H,66,82)(H,67,81)(H,68,79)/b26-24+/t42-,43+,44+,45+,46+,47+,48+,50+,51+,52?,53-,58-/m1/s1
InChiKey: InChIKey=WERRDGNHUUZMKD-PLNIVDNHSA-N

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