Mrv1652309122216492D 30 34 0 0 1 0 999 V2000 0.5244 -3.5848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2787 -3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3664 -2.4302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9453 -3.7367 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3082 -2.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3508 -4.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5489 -5.1095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3416 -5.3383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -4.7663 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1342 -5.5672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7379 -3.9655 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3324 -3.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -3.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3232 -4.4231 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9176 -3.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1158 -4.6519 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7103 -4.0799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5029 -4.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0974 -3.7367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 -3.9655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4845 -3.3934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0882 -4.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4937 -5.3383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7011 -5.1095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1066 -5.6816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 -5.4528 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5121 -6.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7195 -6.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9268 -5.7960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7287 -4.9951 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 2 1 6 0 0 0 4 5 1 1 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 6 0 0 0 9 11 1 0 0 0 0 4 11 1 0 0 0 0 11 12 1 6 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 6 0 0 0 14 16 1 0 0 0 0 16 17 1 6 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 18 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 16 26 1 0 0 0 0 26 27 1 6 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 30 29 1 6 0 0 0 14 30 1 0 0 0 0 9 30 1 0 0 0 0 M END > NP0329942 > NP-MRD > CC(=O)[C@@]1(C)CCC[C@]2(C)[C@H]3CC[C@]4(C)OC5=CC=C(O)C=C5C[C@H]4[C@]3(C)CC[C@@H]12 > InChI=1S/C27H38O3/c1-17(28)24(2)11-6-12-25(3)21(24)9-13-26(4)22(25)10-14-27(5)23(26)16-18-15-19(29)7-8-20(18)30-27/h7-8,15,21-23,29H,6,9-14,16H2,1-5H3/t21-,22+,23-,24+,25-,26+,27-/m0/s1 > BNRLGSUWUGMYKJ-NPLGQECHSA-N > C27H38O3 > 410.598 > 410.282095084 > 3 > 68 > 48.48119846458801 > 1 > 1 > 0 > 0 > 1-[(1R,2S,11S,14R,15R,19S,20R)-6-hydroxy-1,11,15,19-tetramethyl-10-oxapentacyclo[12.8.0.0^{2,11}.0^{4,9}.0^{15,20}]docosa-4,6,8-trien-19-yl]ethan-1-one > 6.269333894666666 > 0 > 5 > 0 > 19.30328088251743 > 10.003930639650013 > -4.855783054789142 > 46.53 > 119.50029999999997 > 1 > 0 > 1-[(1R,2S,11S,14R,15R,19S,20R)-6-hydroxy-1,11,15,19-tetramethyl-10-oxapentacyclo[12.8.0.0^{2,11}.0^{4,9}.0^{15,20}]docosa-4,6,8-trien-19-yl]ethanone > 0 > NP0329942 > 1-[(1s,4ar,4br,6as,12as,12br,14ar)-10-hydroxy-1,4a,6a,12b-tetramethyl-2h,3h,4h,4bh,5h,6h,12h,12ah,13h,14h,14ah-naphtho[2,1-a]xanthen-1-yl]ethanone $$$$