Mrv1652309072217512D 38 41 0 0 1 0 999 V2000 -1.3002 -1.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4526 -1.4713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0991 -2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1779 -2.9916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0169 -3.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3846 -3.7818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4726 -2.3556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9465 -1.8528 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5331 -1.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0121 -0.7438 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6418 -0.1509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2936 -0.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 0.6328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6717 1.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8982 1.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 2.0260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6145 -1.2693 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4068 -1.5546 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5680 -2.3705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9484 -2.9242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1626 -2.6684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5339 -3.2607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7678 -0.8128 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7661 0.0621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6277 0.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8583 1.2506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2703 1.4700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5908 -0.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0527 -1.4381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6917 -2.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4598 -2.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1359 -2.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8688 -2.2382 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8081 -3.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0838 -4.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5364 -4.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7972 -5.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7281 -4.4712 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 3 8 1 0 0 0 0 8 9 1 1 0 0 0 10 9 1 1 0 0 0 2 10 1 0 0 0 0 10 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 0 0 0 0 14 16 2 0 0 0 0 12 17 1 0 0 0 0 17 8 1 1 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 8 21 1 0 0 0 0 21 22 2 0 0 0 0 18 23 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 23 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 18 33 1 0 0 0 0 33 34 1 1 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 M END > NP0252372 > NP-MRD > CC(=O)OC[C@@H]1C(C)(C)CC[C@H](OC(C)=O)[C@]11COC(=O)[C@@]23C[C@@H](CC(OC(C)=O)[C@@H]12)C(=C)C3OC(C)=O > InChI=1S/C28H38O10/c1-14-19-10-20(36-16(3)30)23-27(11-19,24(14)38-18(5)32)25(33)35-13-28(23)21(12-34-15(2)29)26(6,7)9-8-22(28)37-17(4)31/h19-24H,1,8-13H2,2-7H3/t19-,20?,21-,22+,23-,24?,27+,28+/m1/s1 > JWCMFGSMZWWYAM-LZKAJEKNSA-N > C28H38O10 > 534.602 > 534.246497424 > 5 > 76 > 54.31060551803132 > 1 > 0 > 0 > 0 > [(1R,1'S,2R,6S,6'S,9'S)-6,7',11'-tris(acetyloxy)-3,3-dimethyl-10'-methylidene-2'-oxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0^{1,6}]dodecane]-2-yl]methyl acetate > 1.4465539186666667 > 1 > 4 > 0 > -6.330900929947271 > 131.50000000000003 > 130.37550000000002 > 9 > 0 > (1R,1'S,2R,6S,6'S,9'S)-6,7',11'-tris(acetyloxy)-3,3-dimethyl-10'-methylidene-2'-oxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0^{1,6}]dodecane]-2-ylmethyl acetate > 0 > NP0252372 > (1r,1's,2r,6s,6's,9's)-6,7',11'-tris(acetyloxy)-3,3-dimethyl-10'-methylidene-2'-oxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0¹,⁶]dodecan]-2-ylmethyl acetate $$$$