CDK 1030232201 33 33 0 0 0 0 0 0 0 0999 V2000 7.1449 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8594 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5738 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8594 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5738 -0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5738 -2.8876 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8594 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2883 0.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5738 -3.7126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2883 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1449 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8594 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0029 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2883 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0029 -2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4304 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0029 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7173 -2.4751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7159 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7173 -1.6500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4318 -2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 0.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4318 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 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 2.8579 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -1.2375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1435 -1.6500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5724 -1.6500 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 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -2.8876 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 2 4 1 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 5 7 1 6 0 0 0 8 5 1 0 0 0 0 6 9 1 1 0 0 0 6 10 1 0 0 0 0 7 11 2 3 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 1 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 13 17 2 3 0 0 0 18 15 1 0 0 0 0 16 19 2 3 0 0 0 20 17 1 0 0 0 0 18 21 1 1 0 0 0 22 19 1 0 0 0 0 20 23 1 6 0 0 0 22 24 1 0 0 0 0 22 25 1 6 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 28 27 1 0 0 0 0 29 28 1 0 0 0 0 28 30 1 6 0 0 0 29 31 1 6 0 0 0 29 32 1 0 0 0 0 32 33 1 0 0 0 0 18 20 1 0 0 0 0 M END > CHEBI:213334 > (4R,7S,8R,11S,12S)-4,8-dihydroxy-12-[(6S,8Z,10S,11S)-11-hydroxy-6,10-dimethyltrideca-2,4,8-trien-2-yl]-7,11-dimethyl-1-oxacyclododec-9-en-2-one > 2 > (4R,7S,8R,11S,12S)-4,8-dihydroxy-12-[(6S,8Z,10S,11S)-11-hydroxy-6,10-dimethyltrideca-2,4,8-trien-2-yl]-7,11-dimethyl-1-oxacyclododec-9-en-2-one > C28H46O5 > 462.671 > 462.33452 > 0 > O=C1O[C@H](C(=CC=C[C@H](C/C=C\[C@@H]([C@@H](O)CC)C)C)C)[C@H](C=C[C@H](O)[C@H](CC[C@H](C1)O)C)C > InChI=1S/C28H46O5/c1-7-25(30)20(3)12-8-10-19(2)11-9-13-22(5)28-23(6)15-17-26(31)21(4)14-16-24(29)18-27(32)33-28/h8-9,11-13,15,17,19-21,23-26,28-31H,7,10,14,16,18H2,1-6H3/b11-9?,12-8-,17-15?,22-13?/t19-,20-,21-,23-,24+,25-,26-,28+/m0/s1 > BGWOHCNZOGFLGX-RNDOXKLLSA-N $$$$