Mrv1533004171519062D 35 39 0 0 0 0 999 V2000 1.2460 -4.6915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2888 -3.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0238 -3.4928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7159 -3.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0666 -2.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3745 -2.2198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8015 -2.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8444 -1.4702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1486 -1.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4752 -1.5220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7248 -1.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0473 -1.6561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6713 -0.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 0.0055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3714 0.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1915 0.8814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4046 1.1293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7938 1.4304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6714 2.2463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 1.0721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7313 1.8774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3372 1.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2505 0.2337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2229 -0.1623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7538 0.1197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5864 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 0.5484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3053 0.1285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3143 0.9535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0152 -0.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7342 0.1129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0062 -1.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2872 -1.5214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2782 -2.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5773 -1.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 4 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 9 24 1 0 0 0 0 15 24 1 0 0 0 0 24 25 1 0 0 0 0 20 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 8 35 1 0 0 0 0 26 35 1 0 0 0 0 M END > NP0329708 > NP-MRD > CC=C(C)C(=O)OC1C2OC(=O)C(O)C3C(C)C(O)C4(O)OCC23C4C2(C)C(O)C(=O)C=C(C)C12 > InChI=1S/C25H32O10/c1-6-9(2)20(30)34-16-13-10(3)7-12(26)18(29)23(13,5)22-24-8-33-25(22,32)17(28)11(4)14(24)15(27)21(31)35-19(16)24/h6-7,11,13-19,22,27-29,32H,8H2,1-5H3 > FGNINKUIGQDHHQ-UHFFFAOYSA-N > C25H32O10 > 492.521 > 492.19954723 > 8 > 67 > 48.94125240163471 > 1 > 4 > 0 > 0 > 4,5,8,17-tetrahydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-12-yl 2-methylbut-2-enoate > 0.75 > 0.43929732966666657 > -2.44 > 0 > 5 > 0 > 12.309983431618196 > 10.879873174524322 > -3.6559709892684893 > 159.82 > 119.48560000000002 > 3 > 1 > 1.81e+00 g/l > 4,5,8,17-tetrahydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-12-yl 2-methylbut-2-enoate > 0 > NP0329708 > 4,5,8,17-tetrahydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-12-yl 2-methylbut-2-enoate $$$$