Mrv1652309122217122D 28 30 0 0 1 0 999 V2000 5.4278 -1.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1729 -0.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6578 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4828 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1729 1.0799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3883 0.8250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9034 1.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1187 1.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1187 2.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3341 1.4924 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8492 2.1599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1847 2.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8492 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8492 -0.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0646 -0.2549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4515 0.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3341 -0.6674 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8492 -1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1187 -0.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.6674 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3883 -1.3349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0527 -2.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5376 -2.7560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2322 -2.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8967 -2.9285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7473 -1.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3883 -0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6041 0.4125 0.0000 O 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 2 0 0 0 0 3 5 1 0 0 0 0 6 5 1 1 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 6 0 0 0 11 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 1 0 0 0 15 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 6 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 6 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 20 27 1 0 0 0 0 27 2 1 6 0 0 0 6 27 1 0 0 0 0 17 28 1 0 0 0 0 10 28 1 0 0 0 0 M END > NP0330141 > NP-MRD > CO[C@H]1C[C@]2(OC)O[C@@]1(C)C[C@@H](OC(=O)C(C)C)[C@@H]1[C@H](OC(=O)C1=C)\C=C2\C > InChI=1S/C21H30O7/c1-11(2)18(22)27-15-9-20(5)16(24-6)10-21(25-7,28-20)12(3)8-14-17(15)13(4)19(23)26-14/h8,11,14-17H,4,9-10H2,1-3,5-7H3/b12-8-/t14-,15-,16+,17+,20+,21+/m1/s1 > CKIYXPLLXPJWGV-GJICBKNJSA-N > C21H30O7 > 394.464 > 394.199153306 > 5 > 58 > 41.11450919502438 > 1 > 0 > 0 > 1 > (1S,2Z,4R,8R,9R,11S,12S)-1,12-dimethoxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0^{4,8}]tetradec-2-en-9-yl 2-methylpropanoate > 3.185384142666667 > 0 > 3 > 0 > -3.808253857479851 > 80.29 > 100.61489999999999 > 5 > 1 > (1S,2Z,4R,8R,9R,11S,12S)-1,12-dimethoxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0^{4,8}]tetradec-2-en-9-yl 2-methylpropanoate > 0 > NP0330141 > (1s,2z,4r,8r,9r,11s,12s)-1,12-dimethoxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-9-yl 2-methylpropanoate $$$$