21630845 CDK 1020211611 31 32 0 0 0 0 0 0 0 0999 V2000 6.5586 -1.1096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6615 -0.2077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1297 -0.2846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6935 1.9269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9421 1.5004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1297 -2.7597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5586 -3.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9876 -1.1096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9876 -2.7597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 1.1199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 1.1199 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8441 -1.5221 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3289 0.9484 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8441 -2.3472 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4152 0.1279 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5586 -2.7597 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2731 -2.3472 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1095 0.4054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1297 -1.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2731 -1.5221 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8075 1.5324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9876 -0.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7021 0.1279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7021 0.9529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4165 1.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9876 1.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4165 2.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1311 2.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1311 3.4279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8455 3.8404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4165 3.8404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 20 1 0 0 0 0 2 15 1 0 0 0 0 2 18 1 0 0 0 0 15 3 1 6 0 0 0 3 19 1 0 0 0 0 11 4 1 1 0 0 0 13 5 1 1 0 0 0 14 6 1 6 0 0 0 16 7 1 1 0 0 0 20 8 1 1 0 0 0 8 22 1 0 0 0 0 17 9 1 6 0 0 0 10 21 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 11 21 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 1 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 20 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M END > CHEBI:183013 > (2E)-3,7-Dimethyl-2,6-octadien-1-yl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside > 2 > (2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(2E)-3,7-dimethylocta-2,6-dienoxy]oxane-3,4,5-triol > C21H36O10 > 448.509 > 448.23085 > 0 > O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC/C=C(/CCC=C(C)C)\C)CO[C@@H]2OC[C@@](O)([C@H]2O)CO > InChI=1S/C21H36O10/c1-12(2)5-4-6-13(3)7-8-28-19-17(25)16(24)15(23)14(31-19)9-29-20-18(26)21(27,10-22)11-30-20/h5,7,14-20,22-27H,4,6,8-11H2,1-3H3/b13-7+/t14-,15-,16+,17-,18+,19-,20-,21-/m1/s1 > RFFYIBOJHUSIGD-PHDUQKSESA-N $$$$