Mrv1652309122201102D 32 36 0 0 1 0 999 V2000 3.4413 -0.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1401 -0.1587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3244 -0.0355 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5436 -0.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9645 -1.4184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -0.5593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9918 -0.1150 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4891 -0.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0448 -0.9993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 0.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9313 0.8117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1837 1.2677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1346 2.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1996 0.6834 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5045 1.1277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4554 1.9512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1329 0.6039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1683 -0.1642 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2760 -0.8593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0231 0.7325 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6433 1.4649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5377 1.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3534 1.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6547 0.4862 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1692 1.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 1.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2862 0.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1019 0.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7716 -0.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9559 -0.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8043 -1.0928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1988 -0.6097 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 6 0 0 0 4 5 2 0 0 0 0 3 6 1 0 0 0 0 7 6 1 1 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 12 13 1 0 0 0 0 14 12 1 6 0 0 0 7 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 7 18 1 0 0 0 0 18 19 1 1 0 0 0 14 20 1 0 0 0 0 3 20 1 0 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 24 23 1 6 0 0 0 2 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 24 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 M END > NP0321131 > NP-MRD > C[C@H]1OC(=O)[C@]23C(C)=C(C)C(=O)[C@]12O[C@]1(C=O)C(=C)[C@@]2(CC[C@]31C)C=CC(=O)OC2(C)C > InChI=1S/C25H28O7/c1-13-14(2)24-19(29)30-16(4)25(24,18(13)28)32-23(12-26)15(3)22(11-10-21(23,24)7)9-8-17(27)31-20(22,5)6/h8-9,12,16H,3,10-11H2,1-2,4-7H3/t16-,21+,22+,23-,24+,25-/m1/s1 > OPASHUVCAOVDEQ-QZIZNRCXSA-N > C25H28O7 > 440.492 > 440.183503242 > 5 > 60 > 44.38126707146444 > 1 > 0 > 0 > 1 > (1'S,2'R,3R,7'R,9'R,10'R)-2,2,2',10',13',14'-hexamethyl-6'-methylidene-6,12',15'-trioxo-2,6-dihydro-8',11'-dioxaspiro[pyran-3,5'-tetracyclo[7.3.3.0^{1,9}.0^{2,7}]pentadecan]-13'-ene-7'-carbaldehyde > 3.1541359683333345 > 0 > 5 > 0 > -4.3735562623753745 > 95.97000000000001 > 113.96739999999994 > 1 > 1 > (1'S,2'R,3R,7'R,9'R,10'R)-2,2,2',10',13',14'-hexamethyl-6'-methylidene-6,12',15'-trioxo-8',11'-dioxaspiro[pyran-3,5'-tetracyclo[7.3.3.0^{1,9}.0^{2,7}]pentadecan]-13'-ene-7'-carbaldehyde > 0 > NP0321131 > (1's,2'r,3r,7'r,9'r,10'r)-2,2,2',10',13',14'-hexamethyl-6'-methylidene-6,12',15'-trioxo-8',11'-dioxaspiro[pyran-3,5'-tetracyclo[7.3.3.0¹,⁹.0²,⁷]pentadecan]-13'-ene-7'-carbaldehyde $$$$