Mrv1652306242106323D 54 56 0 0 0 0 999 V2000 7.1665 0.0989 0.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3701 -0.2284 -0.5898 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9842 -0.0781 -0.5278 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4236 0.8086 -1.3181 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2524 1.6409 -2.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9881 0.9817 -1.2709 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4084 1.8153 -2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1534 0.1818 -0.3543 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7456 -0.7341 0.4601 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9771 -1.4784 1.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5787 -1.3118 1.3576 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0867 -2.1063 2.2571 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0146 -0.3942 0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7898 0.3703 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0234 1.2576 -1.0796 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1226 1.5323 -0.1542 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5000 2.3157 0.9547 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4029 0.0767 0.2232 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6869 -0.5714 -1.1635 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4807 -0.1689 1.1613 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2180 0.3215 2.4468 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3609 -1.3363 1.0554 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2247 -1.5202 -0.1088 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8908 -0.7226 -0.8813 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0082 0.7441 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6833 -1.3624 -2.0339 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2102 -0.8939 0.3954 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7602 -1.7488 1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2291 -0.0885 0.2844 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0004 1.1598 0.7934 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8754 -0.5195 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 1.0616 -3.1654 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6614 2.5491 -2.4849 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1678 2.0063 -1.7243 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4759 -2.1926 1.9434 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0279 -2.1045 2.4544 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9634 1.9787 -0.6586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2109 2.8559 1.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1852 1.6522 1.5157 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1579 3.0977 0.4792 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2815 0.0823 -1.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9841 -1.6063 -1.0674 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6713 -0.5926 -1.6622 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2601 0.7126 0.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5653 -0.3491 3.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8673 -2.3163 1.2906 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0871 -1.2515 1.9502 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3455 -2.6199 -0.4092 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8592 1.0966 -1.5239 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3996 1.1176 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1526 1.3161 -1.2137 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0887 -1.3561 -2.9499 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9807 -2.3801 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6094 -0.7991 -2.2053 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 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 6 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 2 3 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 9 27 1 0 0 0 0 27 28 2 0 0 0 0 27 3 1 0 0 0 0 14 8 1 0 0 0 0 18 13 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 10 35 1 0 0 0 0 12 36 1 0 0 0 0 16 37 1 6 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 6 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 M END > NP0009069 > NP-MRD > [H]OC1=C([H])C2=C(C3=C1[C@@](C([H])([H])[H])([C@]([H])(O[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])[C@]([H])(O3)C([H])([H])[H])C(=O)C(=C(OC([H])([H])[H])C2=O)C([H])([H])[H] > InChI=1S/C22H26O6/c1-10(2)7-8-15(24)22(5)12(4)28-21-16-13(9-14(23)17(21)22)19(26)20(27-6)11(3)18(16)25/h7,9,12,15,23-24H,8H2,1-6H3/t12-,15-,22-/m1/s1 > HVPDKSONVUABMQ-AVKZDSLQSA-N > C22H26O6 > 386.444 > 386.172938557 > 6 > 54 > 42.124072199935625 > 1 > 2 > 0 > 1 > (2R,3S)-4-hydroxy-3-[(1R)-1-hydroxy-4-methylpent-3-en-1-yl]-7-methoxy-2,3,8-trimethyl-2H,3H,6H,9H-naphtho[1,2-b]furan-6,9-dione > 3.15 > 2.651141976 > -4.02 > 0 > 3 > 0 > 14.40965205136829 > 7.73018601727853 > -3.0915485356421843 > 93.06000000000002 > 107.61920000000002 > 4 > 1 > 3.70e-02 g/l > (2R,3S)-4-hydroxy-3-[(1R)-1-hydroxy-4-methylpent-3-en-1-yl]-7-methoxy-2,3,8-trimethyl-2H-naphtho[1,2-b]furan-6,9-dione > 0 > NP0009069 > Furaquinocin D $$$$