Mrv1652306242117493D 34 36 0 0 0 0 999 V2000 -5.6767 0.5373 -0.3175 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4821 1.0871 -0.8328 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2791 0.5093 -0.3994 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2635 -0.5416 0.4843 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0843 -1.1177 0.9172 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1535 -2.1698 1.8056 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8906 -0.6247 0.4498 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3043 -1.1829 0.8671 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4067 -2.2130 1.7294 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4987 -0.6319 0.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5119 0.4038 -0.5214 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3243 0.9597 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8556 0.4426 -0.4499 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0674 0.9716 -0.8418 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 0.9464 -1.0363 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9281 0.6831 -0.0948 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2510 0.9522 -0.7662 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9313 -0.6839 0.2907 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7531 -1.2331 0.8031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8282 -2.1825 1.5988 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6369 -0.5620 -0.5243 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5734 0.9616 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7177 0.6457 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2028 -0.9587 0.8766 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0205 -2.5369 2.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1701 -2.7691 2.2228 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2984 1.7930 -1.6371 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0807 1.8097 -1.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6981 2.0153 -1.2554 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0028 0.4198 -1.9887 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8058 1.2865 0.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3909 2.0242 -1.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 0.6670 -0.0255 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3716 0.2920 -1.6274 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 5 6 1 0 0 0 0 5 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 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 2 0 0 0 0 11 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 19 20 2 0 0 0 0 14 3 1 0 0 0 0 13 7 1 0 0 0 0 19 10 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 4 24 1 0 0 0 0 6 25 1 0 0 0 0 9 26 1 0 0 0 0 12 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 1 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 M END > NP0003645 > NP-MRD > [H]OC1=C2C(O[H])=C3C(=O)O[C@@]([H])(C([H])([H])[H])C([H])([H])C3=C([H])C2=C([H])C(OC([H])([H])[H])=C1[H] > InChI=1S/C15H14O5/c1-7-3-8-4-9-5-10(19-2)6-11(16)12(9)14(17)13(8)15(18)20-7/h4-7,16-17H,3H2,1-2H3/t7-/m0/s1 > BWNCKEBBYADFPQ-ZETCQYMHSA-N > C15H14O5 > 274.272 > 274.084123551 > 4 > 34 > 28.47279378562031 > 1 > 2 > 0 > 1 > (3S)-9,10-dihydroxy-7-methoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-1-one > 2.55 > 3.1078611586666662 > -3.19 > 0 > 3 > 0 > 9.716545277078671 > 8.460773501088157 > -4.471777320323214 > 75.99000000000001 > 72.6869 > 1 > 1 > 1.77e-01 g/l > (3S)-9,10-dihydroxy-7-methoxy-3-methyl-3H,4H-naphtho[2,3-c]pyran-1-one > 0 > NP0003645 > (-)-semivioxanthin $$$$