Mrv2104 12142312032D 22 24 0 0 1 0 999 V2000 2.7770 2.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 1.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0145 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6465 -0.1178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5032 -0.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6465 0.9428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 1.1270 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0145 1.8414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 1.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1105 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 1.1270 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3977 1.5642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2732 1.9515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4553 2.3388 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 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 7 6 1 0 0 0 0 7 8 1 1 0 0 0 8 9 2 0 0 0 0 7 10 1 6 0 0 0 7 11 1 0 0 0 0 11 3 1 0 0 0 0 11 12 1 6 0 0 0 2 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 4 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 18 1 0 0 0 0 19 14 1 0 0 0 0 19 20 1 1 0 0 0 19 21 1 6 0 0 0 21 22 1 0 0 0 0 M END > NP0332228 > NP-MRD > C[C@]1(CO)CCCC2=C1C=C(O)C1=C2CC[C@](C)(C=C)[C@H]1O > InChI=1S/C19H26O3/c1-4-18(2)9-7-13-12-6-5-8-19(3,11-20)14(12)10-15(21)16(13)17(18)22/h4,10,17,20-22H,1,5-9,11H2,2-3H3/t17-,18-,19+/m0/s1 > QMFJGUWXERQEFG-GBESFXJTSA-N > C19H26O3 > 302.414 > 302.188194697 > 3 > 48 > 34.800179117709725 > 1 > 3 > 0 > 1 > (1R,2R,8S)-2-ethenyl-8-(hydroxymethyl)-2,8-dimethyl-1,2,3,4,5,6,7,8-octahydrophenanthrene-1,10-diol > 3.5332272540000003 > 0 > 3 > 0 > 14.01492723571138 > 10.271294541328546 > -2.7935286824858414 > 60.69 > 88.832 > 2 > 1 > (1R,2R,8S)-2-ethenyl-8-(hydroxymethyl)-2,8-dimethyl-1,3,4,5,6,7-hexahydrophenanthrene-1,10-diol > 0 > NP0332228 > Pleosmaranes E $$$$