Mrv1652309092211282D 34 37 0 0 1 0 999 V2000 3.6913 -1.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5651 -0.6569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -1.2513 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6190 -2.0475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2509 -0.8910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3643 -0.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 0.6950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6668 0.4142 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4839 0.3008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0055 -0.2976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8443 1.0430 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8315 0.7055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4211 2.0054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5708 2.9766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0028 3.6473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9664 3.7613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0742 1.4961 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5368 0.8130 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2232 1.9364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4428 2.5159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5384 2.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 3.3556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3597 0.8720 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8492 1.7383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8664 1.5230 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2742 2.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6422 1.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4926 1.4689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6149 0.4177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8222 0.1889 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4619 -0.5533 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1643 -1.1227 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.2514 1.4371 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4497 1.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 1 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 7 6 1 6 0 0 0 7 8 1 0 0 0 0 8 9 1 6 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 6 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 11 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 1 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 18 23 1 0 0 0 0 23 24 1 1 0 0 0 23 25 1 0 0 0 0 25 26 1 1 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 29 1 1 0 0 0 23 30 1 0 0 0 0 30 31 1 0 0 0 0 2 31 1 0 0 0 0 31 32 1 1 0 0 0 17 33 1 6 0 0 0 7 33 1 0 0 0 0 8 33 1 0 0 0 0 33 34 1 1 0 0 0 M END > NP0282579 > NP-MRD > C[C@H]1C(=O)O[C@H]2[C@@H](Cl)C(=C)[C@@H](O)\C=C\[C@H]3[C@H]4C(=O)[C@@](C)(OC(C)=O)[C@H]([C@H](OC(C)=O)[C@]12O)[C@@]34C > InChI=1S/C24H29ClO9/c1-9-14(28)8-7-13-15-18(29)23(6,34-12(4)27)17(22(13,15)5)20(32-11(3)26)24(31)10(2)21(30)33-19(24)16(9)25/h7-8,10,13-17,19-20,28,31H,1H2,2-6H3/b8-7+/t10-,13-,14-,15-,16-,17+,19-,20-,22-,23-,24-/m0/s1 > SVWXDQMPMMYOJL-GZOFGOLLSA-N > C24H29ClO9 > 496.94 > 496.1500102 > 6 > 63 > 47.51992870168981 > 1 > 2 > 0 > 0 > (1R,2S,3E,5S,7S,8R,11R,12R,13S,14S,15S,17R)-13-(acetyloxy)-7-chloro-5,12-dihydroxy-1,11,15-trimethyl-6-methylidene-10,16-dioxo-9-oxatetracyclo[12.3.0.0^{2,17}.0^{8,12}]heptadec-3-en-15-yl acetate > 0.8544092006666664 > 0 > 4 > 0 > 14.228289775992646 > 12.36162176668294 > -3.1390009262486185 > 136.43 > 117.28619999999997 > 4 > 1 > (1R,2S,3E,5S,7S,8R,11R,12R,13S,14S,15S,17R)-13-(acetyloxy)-7-chloro-5,12-dihydroxy-1,11,15-trimethyl-6-methylidene-10,16-dioxo-9-oxatetracyclo[12.3.0.0^{2,17}.0^{8,12}]heptadec-3-en-15-yl acetate > 0 > NP0282579 > (1r,2s,3e,5s,7s,8r,11r,12r,13s,14s,15s,17r)-13-(acetyloxy)-7-chloro-5,12-dihydroxy-1,11,15-trimethyl-6-methylidene-10,16-dioxo-9-oxatetracyclo[12.3.0.0²,¹⁷.0⁸,¹²]heptadec-3-en-15-yl acetate $$$$