Marvin 09201215482D 72 75 0 0 1 0 999 V2000 7.8774 -3.9421 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5788 -3.5296 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8774 -4.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1349 -3.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2801 -3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5788 -2.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1349 -5.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5788 -5.1796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1349 -2.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9813 -3.5296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2801 -4.6022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8774 -2.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1349 -6.0047 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4337 -4.7259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7239 -3.9421 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8362 -6.4173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3923 -6.4173 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7985 -5.6021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4252 -3.5296 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7239 -4.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9357 -7.0764 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3923 -7.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6911 -5.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1677 -3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4252 -2.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4252 -5.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5375 -7.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1349 -7.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -3.5296 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4252 -6.0047 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1677 -4.7259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5375 -8.4799 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.5703 -3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -2.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1677 -6.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7239 -6.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2388 -8.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8362 -8.8924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2716 -3.5296 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.5703 -2.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1677 -7.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2388 -9.7175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9813 -8.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8362 -9.7175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2716 -2.7046 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.0142 -3.9421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -7.6136 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4252 -7.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9401 -10.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0142 -2.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -8.4386 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.5703 -7.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9401 -10.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5703 -8.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1265 -8.8511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6827 -11.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5703 -9.6762 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.2716 -8.4386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1265 -9.6762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3839 -10.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -10.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2716 -10.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2089 -10.9550 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4153 -11.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5788 -4.3134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6952 -2.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6325 -6.6738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -4.2721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7497 -2.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4614 -2.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1923 -2.6140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7217 -3.5178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 1 0 0 0 2 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 2 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 2 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 2 0 0 0 0 10 15 1 0 0 0 0 13 16 1 6 0 0 0 13 17 1 0 0 0 0 13 18 1 1 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 21 16 1 6 0 0 0 17 22 1 0 0 0 0 17 23 1 1 0 0 0 19 24 1 0 0 0 0 19 25 1 6 0 0 0 20 26 1 0 0 0 0 21 27 1 0 0 0 0 21 28 1 0 0 0 0 24 29 1 0 0 0 0 26 30 1 0 0 0 0 26 31 2 0 0 0 0 27 32 1 0 0 0 0 29 33 1 0 0 0 0 29 34 1 0 0 0 0 30 35 1 0 0 0 0 30 36 1 1 0 0 0 32 37 1 0 0 0 0 32 38 1 1 0 0 0 33 39 1 0 0 0 0 34 40 1 0 0 0 0 35 41 2 0 0 0 0 37 42 2 0 0 0 0 37 43 1 0 0 0 0 38 44 1 0 0 0 0 39 45 1 0 0 0 0 39 46 1 6 0 0 0 41 47 1 0 0 0 0 41 48 1 0 0 0 0 42 49 1 0 0 0 0 45 50 1 1 0 0 0 47 51 1 0 0 0 0 47 52 1 1 0 0 0 49 53 2 0 0 0 0 51 54 1 0 0 0 0 51 55 1 6 0 0 0 53 56 1 0 0 0 0 54 57 1 0 0 0 0 54 58 2 0 0 0 0 55 59 1 0 0 0 0 56 60 2 0 0 0 0 57 61 1 0 0 0 0 57 62 1 6 0 0 0 60 63 1 0 0 0 0 63 64 1 6 0 0 0 9 12 1 0 0 0 0 22 28 1 0 0 0 0 40 45 1 0 0 0 0 61 63 1 0 0 0 0 2 65 1 6 0 0 0 15 66 1 1 0 0 0 21 67 1 1 0 0 0 29 68 1 1 0 0 0 50 69 1 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 46 72 1 0 0 0 0 M END > CHEBI:68478 > everolimus > A macrocyclic lactone that is rapamycin in which the hydroxy group attached to the cyclohexyl moiety has been converted into the corresponding 2-hydroxyethyl ether. It is an immunosuppressant and antineoplastic agent. > 3 > SDZ-RAD; SDZ RAD; RAD001; RAD 001; Everolimus; 42-O-(2-hydroxyethyl)rapamycin; 40-O-(2-hydroxyethyl)-rapamycin; (1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30S,35R)-1,18-dihydroxy-12-{(2R)-1-[(1S,3R,4R)-4-(2-hydroxyethoxy)-3-methoxycyclohexyl]propan-2-yl}-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.0(4,9)]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone > (3S,6R,7E,9R,10R,12R,14S,15E,17E,19E,21S,23S,26R,27R,34aS)-9,27-dihydroxy-3-{(2R)-1-[(1S,3R,4R)-4-(2-hydroxyethoxy)-3-methoxycyclohexyl]propan-2-yl}-10,21-dimethoxy-6,8,12,14,20,26-hexamethyl-9,10,12,13,14,21,22,23,24,25,26,27,32,33,34,34a-hexadecahydro-3H-23,27-epoxypyrido[2,1-c][1,4]oxazacyclohentriacontine-1,5,11,28,29(4H,6H,31H)-pentone > everolimusum; everolimus; everolimus; everolimus > Zortress; Xience V; Votubia; Certican; Afinitor Disperz; Afinitor > C53H83NO14 > 958.22440 > 957.58136 > 0 > [H][C@]1(CC[C@@H](OCCO)[C@@H](C1)OC)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1)OC > InChI=1S/C53H83NO14/c1-32-16-12-11-13-17-33(2)44(63-8)30-40-21-19-38(7)53(62,68-40)50(59)51(60)54-23-15-14-18-41(54)52(61)67-45(35(4)28-39-20-22-43(66-25-24-55)46(29-39)64-9)31-42(56)34(3)27-37(6)48(58)49(65-10)47(57)36(5)26-32/h11-13,16-17,27,32,34-36,38-41,43-46,48-49,55,58,62H,14-15,18-26,28-31H2,1-10H3/b13-11+,16-12+,33-17+,37-27+/t32-,34-,35-,36-,38-,39+,40+,41+,43-,44+,45+,46-,48-,49+,53-/m1/s1 > HKVAMNSJSFKALM-GKUWKFKPSA-N > 159351-69-6 > 159351-69-6 > DB01590 > D02714 > LSM-43172 > Everolimus > 22363408; 22404500; 22461124; 22683823; 22967800; 22969095; 22983698; 22986894; 31478889; 33640871; 33986025; 33998365; 34018490; 34225066; 34242751; 34253597; 34299359; 34467233; 34491881; 34527569 $$$$