Mrv1652309082204582D 38 44 0 0 1 0 999 V2000 4.6989 -1.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8826 -1.7617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -0.9949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7787 -0.7907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1436 -1.3173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7259 0.0326 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9932 -0.4264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2363 0.0281 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4599 -0.1779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3761 0.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2706 1.1609 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2416 1.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7828 0.5142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9173 1.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6843 1.3692 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8892 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3631 -0.0655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7126 0.5180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0165 1.2849 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7132 1.7268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5083 2.5259 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0344 3.1614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6849 2.5780 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2431 3.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4188 3.2404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 1.8110 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3788 0.7797 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3067 1.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7896 0.9152 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3799 1.8291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4331 1.8757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0029 1.1001 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4927 0.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7793 1.1108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5926 1.2493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1192 0.6143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8326 -0.1593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0193 -0.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 6 4 1 6 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 6 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 1 0 0 0 11 14 1 0 0 0 0 15 14 1 6 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 18 1 1 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 6 0 0 0 21 23 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 0 0 0 0 26 23 1 1 0 0 0 19 26 1 0 0 0 0 15 26 1 0 0 0 0 10 27 1 0 0 0 0 27 28 1 1 0 0 0 29 28 1 6 0 0 0 6 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 32 31 1 1 0 0 0 8 32 1 0 0 0 0 27 32 1 0 0 0 0 6 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 33 38 1 0 0 0 0 3 38 1 0 0 0 0 M END > NP0260727 > NP-MRD > CON1C(=O)[C@@]2(C[C@@H]3N=C([C@@H]4C[C@H]2OC[C@H]34)[C@](C)(O)C[C@H]2[C@H]3[C@H](C[C@H](C)[C@H]3CO)OC2=O)C2=CC=CC=C12 > InChI=1S/C29H36N2O7/c1-14-8-22-24(17(14)12-32)16(26(33)38-22)10-28(2,35)25-15-9-23-29(11-20(30-25)18(15)13-37-23)19-6-4-5-7-21(19)31(36-3)27(29)34/h4-7,14-18,20,22-24,32,35H,8-13H2,1-3H3/t14-,15+,16-,17+,18-,20-,22-,23+,24+,28+,29-/m0/s1 > JKNZWTBHBQUFIY-DBEVJBIOSA-N > C29H36N2O7 > 524.614 > 524.252251507 > 7 > 74 > 55.82360602334984 > 1 > 2 > 0 > 0 > (1'R,3S,4'S,7'R,8'S)-6'-[(2R)-1-[(3S,3aS,4R,5S,6aS)-4-(hydroxymethyl)-5-methyl-2-oxo-hexahydro-2H-cyclopenta[b]furan-3-yl]-2-hydroxypropan-2-yl]-1-methoxy-1,2-dihydro-10'-oxa-5'-azaspiro[indole-3,2'-tricyclo[5.3.1.0^{4,8}]undecan]-5'-en-2-one > 1.4242145996666649 > 0 > 7 > 0 > 15.460109676706345 > 13.867073707824755 > 4.983160659048949 > 117.89 > 136.0611 > 5 > 0 > (1'R,3S,4'S,7'R,8'S)-6'-[(2R)-1-[(3S,3aS,4R,5S,6aS)-4-(hydroxymethyl)-5-methyl-2-oxo-hexahydrocyclopenta[b]furan-3-yl]-2-hydroxypropan-2-yl]-1-methoxy-10'-oxa-5'-azaspiro[indole-3,2'-tricyclo[5.3.1.0^{4,8}]undecan]-5'-en-2-one > 0 > NP0260727 > (1'r,3s,4's,7'r,8's)-6'-[(2r)-1-[(3s,3as,4r,5s,6as)-4-(hydroxymethyl)-5-methyl-2-oxo-hexahydrocyclopenta[b]furan-3-yl]-2-hydroxypropan-2-yl]-1-methoxy-10'-oxa-5'-azaspiro[indole-3,2'-tricyclo[5.3.1.0⁴,⁸]undecan]-5'-en-2-one $$$$