Mrv1652309062202372D 30 33 0 0 1 0 999 V2000 2.2488 -1.5057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2666 -1.1839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4288 -0.5142 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3971 -0.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5428 0.4002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9411 1.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 1.7907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 1.6002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5417 1.7164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3678 1.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0623 1.0268 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7340 1.5874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4803 0.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3267 -0.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4724 -1.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8458 -1.9478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0498 -1.6844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2552 -1.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7302 -2.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9919 -3.4838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9432 -2.4034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8765 -1.5443 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0655 -1.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -1.8498 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5413 -2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7829 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9682 -0.4972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9147 -0.8566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5322 -0.3166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 6 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 1 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 22 1 1 0 0 0 4 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 2 25 1 0 0 0 0 25 26 1 1 0 0 0 23 27 1 0 0 0 0 19 27 1 0 0 0 0 27 28 2 0 0 0 0 18 29 1 0 0 0 0 29 30 1 0 0 0 0 15 30 1 0 0 0 0 M END > NP0222724 > NP-MRD > C[C@H]1C[C@@]23OC(=O)\C(C2=O)=C2\OC\C(\C=C2)=C/[C@H](O)C\C=C/C(/C)=C\[C@@]3(C)C=C1C > InChI=1S/C25H28O5/c1-15-6-5-7-19(26)10-18-8-9-20(29-14-18)21-22(27)25(30-23(21)28)13-17(3)16(2)12-24(25,4)11-15/h5-6,8-12,17,19,26H,7,13-14H2,1-4H3/b6-5-,15-11-,18-10-,21-20+/t17-,19+,24-,25+/m0/s1 > SWMOMSBFRQXQAA-YHHWUCIQSA-N > C25H28O5 > 408.494 > 408.193674002 > 4 > 58 > 43.9063890077751 > 1 > 1 > 0 > 1 > (5S,7S,10R,11E,13E,16R)-16-hydroxy-7,8,10,12-tetramethyl-4,20-dioxatetracyclo[16.2.2.1^{2,5}.0^{5,10}]tricosa-1,8,11,13,17,21-hexaene-3,23-dione > 3.436692047999999 > 0 > 4 > 0 > 14.80705281407755 > -2.883195099122479 > 72.83 > 120.37979999999997 > 0 > 1 > (5S,7S,10R,11E,13E,16R)-16-hydroxy-7,8,10,12-tetramethyl-4,20-dioxatetracyclo[16.2.2.1^{2,5}.0^{5,10}]tricosa-1,8,11,13,17,21-hexaene-3,23-dione > 0 > NP0222724 > (1e,5s,7s,10r,11e,13e,16r,17z)-16-hydroxy-7,8,10,12-tetramethyl-4,20-dioxatetracyclo[16.2.2.1²,⁵.0⁵,¹⁰]tricosa-1,8,11,13,17,21-hexaene-3,23-dione $$$$