Mrv0541 04121512072D 18 20 0 0 0 0 999 V2000 1.4009 -0.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4009 -1.3553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4454 -0.1105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 0.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 0.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -2.2539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4454 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -2.2539 0.0000 O 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 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 8 14 1 0 0 0 0 14 15 2 0 0 0 0 5 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 2 17 1 0 0 0 0 17 18 1 0 0 0 0 M END > NP0167182 > NP-MRD > CC1(C)OC2=CC=C3C=CC(=O)OC3=C2CC1O > InChI=1S/C14H14O4/c1-14(2)11(15)7-9-10(18-14)5-3-8-4-6-12(16)17-13(8)9/h3-6,11,15H,7H2,1-2H3 > UJSHBYQGQRPVNO-UHFFFAOYSA-N > C14H14O4 > 246.262 > 246.089208931 > 3 > 32 > 25.357658156704247 > 1 > 1 > 0 > 1 > 13-hydroxy-12,12-dimethyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,5,7,9-tetraen-4-one > 2.00 > 1.7323936069999994 > -2.48 > 0 > 3 > 0 > 13.751990609002451 > -3.344679307622327 > 55.760000000000005 > 66.34090000000002 > 0 > 1 > 8.22e-01 g/l > 13-hydroxy-12,12-dimethyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,5,7,9-tetraen-4-one > 0 > NP0167182 > 9-hydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one $$$$