Mrv1652309052218242D 33 37 0 0 1 0 999 V2000 2.6419 2.3180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9588 1.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7894 1.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1332 0.7251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9548 0.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 0.0462 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0079 -0.7014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8298 -0.7730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3028 -0.0971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1786 -1.5206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9885 -1.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0893 -2.4967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -2.8455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7789 -2.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8281 0.1194 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2176 -0.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4117 -0.6435 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8164 -1.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -2.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8007 -2.7913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5711 -2.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0789 -2.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2971 -2.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3061 -1.6369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0935 -1.3906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5574 -0.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1508 0.1622 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8101 0.5007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4154 0.8988 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7079 1.4538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9575 1.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4557 1.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1375 0.9156 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 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 6 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 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 10 14 2 0 0 0 0 6 15 1 0 0 0 0 15 16 1 6 0 0 0 15 17 1 0 0 0 0 17 18 1 1 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 21 25 2 0 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 1 0 0 0 29 28 1 6 0 0 0 2 29 1 0 0 0 0 15 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 27 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 M END > NP0216441 > NP-MRD > CC1=CC(=O)[C@H](OC(=O)C2=COC=C2)[C@@]2(C)[C@H](C[C@H]3C[C@]12OC3(C)C)OC(=O)C1=COC=C1 > InChI=1S/C25H26O8/c1-14-9-18(26)20(32-22(28)16-6-8-30-13-16)24(4)19(31-21(27)15-5-7-29-12-15)10-17-11-25(14,24)33-23(17,2)3/h5-9,12-13,17,19-20H,10-11H2,1-4H3/t17-,19-,20-,24+,25-/m0/s1 > CZRPXWCWVJAUKP-XCJBEJMVSA-N > C25H26O8 > 454.475 > 454.162767797 > 4 > 59 > 35.97778030369402 > 1 > 0 > 0 > 1 > (1S,5R,6R,7S,9S)-7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0^{1,6}]dodec-2-en-5-yl furan-3-carboxylate > 4.137754146333334 > 1 > 5 > 0 > 15.02518347857595 > -2.7653739923356677 > 105.18 > 115.44059999999999 > 6 > 1 > (1S,5R,6R,7S,9S)-7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0^{1,6}]dodec-2-en-5-yl furan-3-carboxylate > 0 > NP0216441 > (1s,5r,6r,7s,9s)-7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0¹,⁶]dodec-2-en-5-yl furan-3-carboxylate $$$$