Marvin 04041311102D 36 38 0 0 0 0 999 V2000 0.2670 0.4546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1414 -0.2620 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6836 -0.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9969 -0.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -1.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2833 -1.5064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2851 0.1466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5697 -0.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5708 -1.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8579 -1.5040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1393 -1.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8556 0.1530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7128 -1.5055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 -1.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1417 -1.5043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8559 -1.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1424 -2.3293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2815 -2.3314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7114 0.1462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2875 0.9716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 1.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0019 1.3841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 2.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8586 2.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1445 2.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5696 2.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5699 3.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1496 3.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8605 3.4422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2839 3.8574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2838 2.2053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 0.4593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5004 1.1762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3254 1.1809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7338 1.8977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7419 0.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 1 1 6 0 0 0 3 2 1 0 0 0 0 11 2 1 0 0 0 0 2 12 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 7 4 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 18 1 0 0 0 0 6 9 2 0 0 0 0 7 20 1 0 0 0 0 8 7 2 0 0 0 0 8 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 29 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 M END > CHEBI:73099 > (R)-mallotophilippen E > The (R)-enantiomer of mallotophilippen E. > 3 > (2E)-1-[(2R)-5,7-dihydroxy-2-methyl-6-(3-methylbut-2-en-1-yl)-2-(4-methylpent-3-en-1-yl)-2H-chromen-8-yl]-3-(3,4-dihydroxyphenyl)prop-2-en-1-one > C30H34O6 > 490.58740 > 490.23554 > 0 > CC(C)=CCC[C@@]1(C)Oc2c(C=C1)c(O)c(CC=C(C)C)c(O)c2C(=O)\C=C\c1ccc(O)c(O)c1 > InChI=1S/C30H34O6/c1-18(2)7-6-15-30(5)16-14-22-27(34)21(11-8-19(3)4)28(35)26(29(22)36-30)24(32)13-10-20-9-12-23(31)25(33)17-20/h7-10,12-14,16-17,31,33-35H,6,11,15H2,1-5H3/b13-10+/t30-/m1/s1 > SEHURCMYIALHJN-SZNWCZRISA-N $$$$