Mrv1652309102219222D 36 40 0 0 1 0 999 V2000 3.8134 0.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0467 0.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2182 -0.5794 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1049 -0.4175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5686 -1.0998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5643 0.3193 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9185 -0.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2446 1.0798 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7433 1.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5618 1.6336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 2.2907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8816 0.8730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 1.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4421 0.2677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3828 0.2159 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7025 -0.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 -0.6480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0198 0.0091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8407 -1.4085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6592 -1.5119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4138 1.3181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6674 0.7879 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3245 1.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5022 1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2519 2.5611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9443 1.1535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1966 0.3545 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6490 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8264 -1.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -1.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5021 -0.9385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1721 -0.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0203 0.1991 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4865 -0.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3175 -0.6153 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8581 -1.3006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 3 2 1 6 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 6 8 1 0 0 0 0 8 9 1 1 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 6 15 1 0 0 0 0 15 16 1 6 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 8 21 1 0 0 0 0 21 22 1 0 0 0 0 22 2 1 6 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 6 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 28 32 2 0 0 0 0 27 33 1 0 0 0 0 22 33 1 0 0 0 0 33 34 1 6 0 0 0 33 35 1 0 0 0 0 3 35 1 0 0 0 0 35 36 1 6 0 0 0 M END > NP0303205 > NP-MRD > COC(=O)C[C@H]1C(C)(C)C(=O)C[C@@H]2O[C@]34CC(=O)O[C@@H](C5=COC=C5)[C@]3(C)[C@@H](O)[C@@H](C4=C)C(=O)[C@]12C > InChI=1S/C27H32O9/c1-13-20-21(31)25(4)15(9-18(29)33-6)24(2,3)16(28)10-17(25)36-27(13)11-19(30)35-23(14-7-8-34-12-14)26(27,5)22(20)32/h7-8,12,15,17,20,22-23,32H,1,9-11H2,2-6H3/t15-,17-,20-,22-,23-,25+,26-,27-/m0/s1 > UIVILBNOHPPLBO-HTFLMJRCSA-N > C27H32O9 > 500.544 > 500.20463261 > 6 > 68 > 50.1306125079448 > 1 > 1 > 0 > 0 > methyl 2-[(1S,3S,7S,8R,10R,11S,12S,13R)-13-(furan-3-yl)-11-hydroxy-6,6,8,12-tetramethyl-17-methylidene-5,9,15-trioxo-2,14-dioxatetracyclo[8.6.1.0^{1,12}.0^{3,8}]heptadecan-7-yl]acetate > 2.332135474999999 > 0 > 5 > 0 > 13.792305315077819 > 10.526368269720288 > -2.8697578217266515 > 129.34 > 123.47669999999998 > 4 > 0 > methyl [(1S,3S,7S,8R,10R,11S,12S,13R)-13-(furan-3-yl)-11-hydroxy-6,6,8,12-tetramethyl-17-methylidene-5,9,15-trioxo-2,14-dioxatetracyclo[8.6.1.0^{1,12}.0^{3,8}]heptadecan-7-yl]acetate > 0 > NP0303205 > methyl 2-[(1s,3s,7s,8r,10r,11s,12s,13s)-13-(furan-3-yl)-11-hydroxy-6,6,8,12-tetramethyl-17-methylidene-5,9,15-trioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-7-yl]acetate $$$$