Mrv1652304282211202D 23 23 0 0 1 0 999 V2000 2.5006 -1.0312 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5006 -1.8562 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7862 -2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 -1.8562 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.2062 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0717 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 1.8562 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5006 1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3989 2.5847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1735 2.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -0.6187 0.0000 C 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 1 15 1 0 0 0 0 10 16 1 6 0 0 0 10 17 1 1 0 0 0 7 18 1 1 0 0 0 18 19 1 0 0 0 0 6 20 1 0 0 0 0 4 21 1 1 0 0 0 2 22 1 1 0 0 0 1 23 1 1 0 0 0 M END > NP0065058 > NP-MRD > CO[C@H]1\C=C\[C@@](C)(O)CCC(=O)O[C@H](C)[C@@H](C)C[C@@H](O)\C=C1/C > InChI=1S/C18H30O5/c1-12-10-15(19)11-13(2)16(22-5)6-8-18(4,21)9-7-17(20)23-14(12)3/h6,8,11-12,14-16,19,21H,7,9-10H2,1-5H3/b8-6+,13-11+/t12-,14+,15+,16-,18+/m0/s1 > OQBWAWZWLOIZFL-VJTQDIFFSA-N > C18H30O5 > 326.433 > 326.209324066 > 4 > 53 > 35.72776826231798 > 1 > 2 > 0 > 1 > (5S,6E,8S,9E,11R,13S,14R)-5,11-dihydroxy-8-methoxy-5,9,13,14-tetramethyl-1-oxacyclotetradeca-6,9-dien-2-one > 1.57 > 1.838912530999998 > -2.81 > 0 > 1 > 0 > 15.074057181656613 > 14.447964966258862 > -2.8584427427851047 > 75.99000000000001 > 90.90459999999999 > 1 > 1 > 5.03e-01 g/l > (5S,6E,8S,9E,11R,13S,14R)-5,11-dihydroxy-8-methoxy-5,9,13,14-tetramethyl-1-oxacyclotetradeca-6,9-dien-2-one > 0 > NP0065058 > Albocycline M-6 $$$$