Mrv0541 02241220562D 28 30 0 0 0 0 999 V2000 1.2643 -10.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2985 -10.5550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5843 -10.1422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8759 -10.5550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1617 -10.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5523 -10.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3009 -11.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9749 -10.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6945 -10.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4031 -10.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4039 -11.1575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5899 -11.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8814 -11.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1674 -11.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5467 -11.5089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2608 -11.9274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9693 -11.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6889 -11.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4031 -11.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5956 -12.7419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -12.7474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2552 -12.7531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6834 -12.7531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0182 -10.1422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1115 -10.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8257 -10.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5397 -10.1589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8201 -11.1798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 14 15 1 0 0 0 0 1 8 2 0 0 0 0 15 16 1 0 0 0 0 4 5 1 0 0 0 0 16 17 2 0 0 0 0 8 9 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 9 10 2 0 0 0 0 12 20 1 0 0 0 0 5 6 1 0 0 0 0 14 21 2 0 0 0 0 10 11 1 0 0 0 0 16 22 1 0 0 0 0 6 1 1 0 0 0 0 18 23 2 0 0 0 0 7 12 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 10 25 1 0 0 0 0 12 13 2 0 0 0 0 25 26 1 0 0 0 0 2 7 2 0 0 0 0 26 27 1 0 0 0 0 13 14 1 0 0 0 0 26 28 2 0 0 0 0 4 13 1 0 0 0 0 6 15 2 0 0 0 0 8 17 1 0 0 0 0 M END > NP0338422 > NP-MRD > CC(=O)C1=C(O)C2=C(CC3=CC(O)=CC(O)=C3C2=O)C=C1\C=C(/O)CC(O)=O > InChI=1S/C20H16O8/c1-8(21)16-10(4-13(23)7-15(25)26)2-9-3-11-5-12(22)6-14(24)17(11)20(28)18(9)19(16)27/h2,4-6,22-24,27H,3,7H2,1H3,(H,25,26)/b13-4- > OVIPDYYHLHEFDF-PQMHYQBVSA-N > C20H16O8 > 384.3362 > 384.084517488 > 8 > 38.0055348299544 > 1 > 5 > 0 > 1 > (3Z)-4-(3-acetyl-4,5,7-trihydroxy-10-oxo-9,10-dihydroanthracen-2-yl)-3-hydroxybut-3-enoic acid > 2.14 > 3.724915681666666 > -3.85 > 0 > 3 > -1 > 7.373500854314681 > 3.324099274469886 > -2.671190040541428 > 152.36 > 100.17669999999998 > 4 > 1 > 5.47e-02 g/l > tetracenomycin F2 > 0 > NP0338422 > Theasaponin F2 $$$$