Mrv1652309122217202D 19 22 0 0 1 0 999 V2000 2.7591 3.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5437 2.9326 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2112 3.4175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2112 4.2425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8786 2.9326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6237 2.1479 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2911 1.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 0.8784 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2605 1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 0.2653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2911 0.0938 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6237 -0.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7987 -0.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1312 0.0938 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7957 -0.6599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3242 0.2653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8763 0.8784 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1312 1.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7987 2.1479 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 6 5 1 6 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 1 0 0 0 8 10 1 0 0 0 0 11 10 1 1 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 1 0 0 0 14 16 1 0 0 0 0 17 16 1 6 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 19 18 1 1 0 0 0 2 19 1 0 0 0 0 6 19 1 0 0 0 0 M END > NP0330209 > NP-MRD > C[C@H]1[C@@H]2C[C@H]3O[C@@]3(C)CC[C@@H]3O[C@@]3(C)C[C@H]2OC1=O > InChI=1S/C15H22O4/c1-8-9-6-12-14(2,19-12)5-4-11-15(3,18-11)7-10(9)17-13(8)16/h8-12H,4-7H2,1-3H3/t8-,9-,10+,11-,12+,14-,15-/m0/s1 > NEDIZKCLFIUESJ-ZYZASJKDSA-N > C15H22O4 > 266.337 > 266.151809188 > 3 > 41 > 28.418560348202966 > 1 > 0 > 0 > 1 > (1S,3R,5S,8S,10S,12R,15S)-5,10,15-trimethyl-4,9,13-trioxatetracyclo[10.3.0.0^{3,5}.0^{8,10}]pentadecan-14-one > 1.644247459666666 > 0 > 4 > 0 > -3.92344183160018 > 51.36 > 67.77440000000001 > 0 > 1 > (1S,3R,5S,8S,10S,12R,15S)-5,10,15-trimethyl-4,9,13-trioxatetracyclo[10.3.0.0^{3,5}.0^{8,10}]pentadecan-14-one > 0 > NP0330209 > (1s,3r,5s,8s,10s,12r,15s)-5,10,15-trimethyl-4,9,13-trioxatetracyclo[10.3.0.0³,⁵.0⁸,¹⁰]pentadecan-14-one $$$$