16731462 CDK 1109211115 35 38 0 0 0 0 0 0 0 0999 V2000 3.2399 0.4390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9444 -3.3307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4548 0.0735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3832 0.0265 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3832 -0.7985 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6688 -1.2110 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9543 -0.7985 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1640 0.2779 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6688 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 -1.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9543 0.0265 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6454 -0.3860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2036 -1.2167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6821 -2.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4202 1.0620 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3832 0.8515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9411 -2.5057 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1970 -2.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2099 -0.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4389 -0.7513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2275 1.2322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8693 1.6761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4252 -2.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6569 -1.1869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4838 2.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -2.0820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2911 2.1865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5474 2.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8420 1.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3547 3.1408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9964 3.5847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4575 -1.4959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2788 -1.5570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5616 -0.4479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8567 0.3867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11 1 1 6 0 0 0 17 2 1 1 0 0 0 3 20 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 16 1 1 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 32 1 6 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 6 33 1 1 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 34 1 6 0 0 0 8 12 1 0 0 0 0 8 15 1 0 0 0 0 8 35 1 6 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 1 0 0 0 13 20 1 0 0 0 0 14 17 1 0 0 0 0 15 21 1 0 0 0 0 15 22 1 6 0 0 0 17 18 1 0 0 0 0 18 23 2 0 0 0 0 20 24 1 0 0 0 0 21 25 1 0 0 0 0 23 26 1 0 0 0 0 24 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 M END > CHEBI:183589 > Stoloniferone P > 2 > (6R,8S,9S,10R,11R,13R,14S,17R)-6,11-dihydroxy-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-1-one > C28H42O3 > 426.641 > 426.31340 > 0 > O[C@H]1[C@]2([C@]([C@]3([C@@]([C@](CC3)([C@@H](CCC(C(C)C)=C)C)[H])(C1)C)[H])(C[C@@H](O)C=4[C@]2(C)C(=O)C=CC4)[H])[H] > InChI=1S/C28H42O3/c1-16(2)17(3)10-11-18(4)20-12-13-21-19-14-23(29)22-8-7-9-25(31)28(22,6)26(19)24(30)15-27(20,21)5/h7-9,16,18-21,23-24,26,29-30H,3,10-15H2,1-2,4-6H3/t18-,19+,20-,21+,23-,24-,26-,27-,28-/m1/s1 > ORIPLJIEQPXYQX-OWKHESKOSA-N > LMST01031101 $$$$