Mrv1652309082204542D 34 38 0 0 1 0 999 V2000 3.4349 -1.3476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -1.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2638 -0.5288 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7365 0.1473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4419 -0.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9692 -1.1336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0927 0.2900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5654 0.9661 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0699 1.1714 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9191 1.5408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8103 2.3735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4391 2.9076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0101 2.6140 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3403 3.3701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5998 1.9247 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6633 1.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7515 2.3340 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9217 1.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1828 0.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5512 1.2899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6216 2.1249 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3856 2.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4979 3.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8463 3.7595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2619 3.5648 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9136 3.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3743 4.3822 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1383 4.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7227 4.8881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 2.6704 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1004 3.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9014 3.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2206 4.5107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3012 3.0308 0.0000 C 0 0 2 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 6 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 8 7 1 6 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 6 0 0 0 13 15 1 0 0 0 0 8 15 1 0 0 0 0 15 16 1 1 0 0 0 17 16 1 6 0 0 0 17 18 1 0 0 0 0 9 18 1 1 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 6 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 6 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 6 0 0 0 21 30 1 0 0 0 0 17 30 1 0 0 0 0 30 31 1 1 0 0 0 31 32 1 0 0 0 0 32 33 1 6 0 0 0 34 32 1 6 0 0 0 13 34 1 0 0 0 0 17 34 1 0 0 0 0 M END > NP0260678 > NP-MRD > CC[C@@H](C)C(=O)O[C@@H]1[C@H]2C[C@]34[C@@H]5C[C@H](O)[C@@H]3[C@@]2(C)C(=O)O[C@H]1C4=CO[C@@H]5OC(=O)[C@H](C)[C@H](C)O > InChI=1S/C25H34O9/c1-6-10(2)20(28)32-17-14-8-25-13-7-16(27)19(25)24(14,5)23(30)33-18(17)15(25)9-31-22(13)34-21(29)11(3)12(4)26/h9-14,16-19,22,26-27H,6-8H2,1-5H3/t10-,11-,12+,13-,14-,16+,17-,18+,19-,22-,24+,25-/m1/s1 > AEMNOUFSJNXGFJ-LDQTYSTRSA-N > C25H34O9 > 478.538 > 478.220282675 > 6 > 68 > 48.89111733027361 > 1 > 2 > 0 > 1 > (1R,5R,6S,8S,9S,10S,13S,14R,15S)-8-hydroxy-10-methyl-14-{[(2R)-2-methylbutanoyl]oxy}-11-oxo-4,12-dioxapentacyclo[7.7.0.0^{1,6}.0^{2,13}.0^{10,15}]hexadec-2-en-5-yl (2R,3S)-3-hydroxy-2-methylbutanoate > 1.6320898693333314 > 1 > 5 > 0 > 15.25415165455857 > 14.636728706510869 > -2.7868310812065937 > 128.59 > 116.1441 > 8 > 1 > (1R,5R,6S,8S,9S,10S,13S,14R,15S)-8-hydroxy-10-methyl-14-{[(2R)-2-methylbutanoyl]oxy}-11-oxo-4,12-dioxapentacyclo[7.7.0.0^{1,6}.0^{2,13}.0^{10,15}]hexadec-2-en-5-yl (2R,3S)-3-hydroxy-2-methylbutanoate > 0 > NP0260678 > (1r,5r,6s,8s,9s,10s,13s,14r,15s)-8-hydroxy-10-methyl-14-{[(2r)-2-methylbutanoyl]oxy}-11-oxo-4,12-dioxapentacyclo[7.7.0.0¹,⁶.0²,¹³.0¹⁰,¹⁵]hexadec-2-en-5-yl (2r,3s)-3-hydroxy-2-methylbutanoate $$$$