Mrv1533004241508462D 30 33 0 0 0 0 999 V2000 -1.8903 -6.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6203 -5.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8407 -6.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3998 -5.5245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3502 -5.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8903 -4.3914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5401 -4.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -4.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8101 -3.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6203 -3.6118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5401 -2.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -2.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8101 -3.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6203 -2.9882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1604 -3.6118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9705 -3.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2405 -2.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0507 -2.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5908 -3.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1111 -2.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3116 -3.5454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3207 -3.9236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5106 -4.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2405 -4.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4304 -5.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1604 -5.7946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8903 -4.3914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0802 -4.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8101 -5.3268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5401 -3.9236 0.0000 C 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 2 4 1 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 16 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 15 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 8 30 1 0 0 0 0 13 30 2 0 0 0 0 M END > NP0207365 > NP-MRD > CC(C)(O)C(O)CC1=C(O)C=CC2=C1C(=O)C1=C(O)C=C3OC(C)(C)C=CC3=C1O2 > InChI=1S/C23H24O7/c1-22(2)8-7-11-16(30-22)10-14(25)19-20(27)18-12(9-17(26)23(3,4)28)13(24)5-6-15(18)29-21(11)19/h5-8,10,17,24-26,28H,9H2,1-4H3 > BKIZQFZDTGMFFX-UHFFFAOYSA-N > C23H24O7 > 412.438 > 412.152203113 > 6 > 54 > 43.47463941450593 > 1 > 4 > 0 > 1 > 9-(2,3-dihydroxy-3-methylbutyl)-8,11-dihydroxy-2,2-dimethyl-2,10-dihydro-1,5-dioxatetraphen-10-one > 3.21 > 3.491261167666666 > -3.97 > 0 > 4 > 0 > 9.411270988538332 > 8.48985784394525 > -3.094068170607785 > 116.45000000000002 > 111.76189999999998 > 3 > 1 > 4.46e-02 g/l > 9-(2,3-dihydroxy-3-methylbutyl)-8,11-dihydroxy-2,2-dimethyl-1,5-dioxatetraphen-10-one > 0 > NP0207365 > 9-(2,3-dihydroxy-3-methylbutyl)-8,11-dihydroxy-2,2-dimethyl-1,5-dioxatetraphen-10-one $$$$