CDK 1030232201 38 39 0 0 0 0 0 0 0 0999 V2000 -0.5495 0.7013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1435 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 2.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8579 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1435 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0165 2.7770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1435 2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1435 3.3001 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1435 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 3.3001 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1435 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6122 0.9927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2870 3.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 3.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1435 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8579 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 4 2 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 1 1 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 12 6 1 0 0 0 0 8 13 1 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 6 0 0 0 15 19 2 0 0 0 0 20 15 1 0 0 0 0 16 21 1 0 0 0 0 16 22 2 0 0 0 0 17 23 2 0 0 0 0 24 17 1 0 0 0 0 20 25 1 0 0 0 0 20 26 1 1 0 0 0 21 27 1 0 0 0 0 22 28 1 0 0 0 0 24 29 1 0 0 0 0 24 30 1 1 0 0 0 25 31 1 0 0 0 0 28 32 2 0 0 0 0 29 33 1 0 0 0 0 33 34 2 0 0 0 0 35 33 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 6 0 0 0 36 38 1 0 0 0 0 8 11 2 0 0 0 0 24 28 1 0 0 0 0 M END > CHEBI:211082 > Gilluone B > 2 > [(1R,5R)-5-[[(5R)-4-amino-5-hydroxy-2-methoxy-5-methyl-3-[(2R)-2-methylbutanoyl]-6-oxocyclohexa-1,3-dien-1-yl]methyl]-4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl] (2R)-2-methylbutanoate > C28H39NO9 > 533.618 > 533.26248 > 0 > O=C1C(=C(OC)C(C(=O)[C@@H](CC)C)=C([C@]1(O)C)N)C[C@@]2(C(OC)=CC(=O)[C@](C2=O)(OC(=O)[C@@H](CC)C)C)C > InChI=1S/C28H39NO9/c1-10-14(3)20(31)19-21(37-9)16(23(32)27(6,35)22(19)29)13-26(5)18(36-8)12-17(30)28(7,25(26)34)38-24(33)15(4)11-2/h12,14-15,35H,10-11,13,29H2,1-9H3/t14-,15-,26-,27-,28-/m1/s1 > OMJCMAHMVILRNE-NMVZWQPUSA-N $$$$