6326151 CDK 1222231031 93100 0 0 0 0 0 0 0 0999 V2000 9.9521 1.5102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5232 1.5102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5232 -0.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1271 2.3352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9521 -0.1398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -1.2128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0943 -0.1398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5458 -3.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9917 3.3747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3594 0.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5396 4.4298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8098 -2.5897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2147 -3.2701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3499 2.6323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9531 -3.4022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0943 2.3352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2387 -1.7648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7892 -2.3291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 4.1818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0531 -1.2684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0767 -1.9913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8323 -5.2753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3829 -5.8396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6467 -4.7790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3721 0.5406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3798 1.0977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5502 4.7338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1354 -3.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3060 1.5704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5654 -3.3341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0929 0.2727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0929 -1.3773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3090 4.4305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6092 3.4147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5232 -0.1398 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2377 0.2727 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2377 1.0977 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8087 0.2727 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9521 2.3352 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8087 1.0977 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2071 3.1198 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5396 3.6048 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8912 -1.4951 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8722 3.1198 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0345 -2.3076 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4025 -2.8378 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6272 -2.5557 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7274 -0.4220 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4840 -1.7431 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7368 2.0802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0943 1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8707 -1.2344 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6459 -1.5166 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0876 3.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2779 -0.9863 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1346 -0.1738 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3210 -3.9325 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7088 -1.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4643 -4.7450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2396 -5.0271 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8715 -4.4968 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7282 -3.6844 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5471 0.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3798 0.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1632 4.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3602 -3.1541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1345 2.3773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8133 4.6896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6654 -0.1398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9336 -2.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8995 2.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5783 4.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6985 5.5066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9508 0.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1582 -3.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2284 4.8885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3486 6.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5496 2.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2364 -0.1398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1135 5.7055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3145 2.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 0.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2364 -0.9648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -0.1398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 -1.3773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4292 3.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9646 1.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -0.9648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1942 3.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7294 2.2886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8443 3.1056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0929 1.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6589 4.9384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37 1 1 6 0 0 0 39 1 1 6 0 0 0 2 37 1 0 0 0 0 2 40 1 0 0 0 0 35 3 1 1 0 0 0 43 3 1 6 0 0 0 4 39 1 0 0 0 0 4 44 1 0 0 0 0 36 5 1 6 0 0 0 48 5 1 6 0 0 0 6 43 1 0 0 0 0 6 49 1 0 0 0 0 38 7 1 6 0 0 0 7 64 1 0 0 0 0 46 8 1 1 0 0 0 57 8 1 1 0 0 0 41 9 1 6 0 0 0 9 65 1 0 0 0 0 10 48 1 0 0 0 0 10 56 1 0 0 0 0 42 11 1 1 0 0 0 45 12 1 6 0 0 0 47 13 1 6 0 0 0 14 50 1 0 0 0 0 14 67 1 0 0 0 0 15 57 1 0 0 0 0 15 62 1 0 0 0 0 16 51 1 0 0 0 0 52 17 1 1 0 0 0 53 18 1 6 0 0 0 19 54 1 0 0 0 0 55 20 1 1 0 0 0 21 58 1 0 0 0 0 21 70 1 0 0 0 0 59 22 1 1 0 0 0 60 23 1 6 0 0 0 61 24 1 1 0 0 0 25 63 1 0 0 0 0 26 64 2 0 0 0 0 27 65 2 0 0 0 0 28 66 1 0 0 0 0 29 67 2 0 0 0 0 30 70 2 0 0 0 0 31 84 1 0 0 0 0 31 92 1 0 0 0 0 32 88 1 0 0 0 0 33 89 1 0 0 0 0 33 93 1 0 0 0 0 34 91 1 0 0 0 0 35 36 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 39 50 1 0 0 0 0 40 51 1 1 0 0 0 41 42 1 0 0 0 0 42 44 1 0 0 0 0 43 45 1 0 0 0 0 44 54 1 6 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 49 1 0 0 0 0 48 52 1 0 0 0 0 49 58 1 1 0 0 0 52 53 1 0 0 0 0 53 55 1 0 0 0 0 55 56 1 0 0 0 0 56 63 1 6 0 0 0 57 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 66 1 6 0 0 0 64 69 1 0 0 0 0 65 68 1 0 0 0 0 67 71 1 0 0 0 0 68 72 2 0 0 0 0 68 73 1 0 0 0 0 69 74 2 0 0 0 0 70 75 1 0 0 0 0 71 78 2 0 0 0 0 72 76 1 0 0 0 0 73 77 2 0 0 0 0 74 79 1 0 0 0 0 76 80 2 0 0 0 0 77 80 1 0 0 0 0 78 81 1 0 0 0 0 79 82 2 0 0 0 0 79 83 1 0 0 0 0 81 86 2 0 0 0 0 81 87 1 0 0 0 0 82 84 1 0 0 0 0 83 85 2 0 0 0 0 84 88 2 0 0 0 0 85 88 1 0 0 0 0 86 89 1 0 0 0 0 87 90 2 0 0 0 0 89 91 2 0 0 0 0 90 91 1 0 0 0 0 M END > CHEBI:228309 > Tenuifoliose P > 2 > [(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-4-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,5-dihydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-5-(hydroxymethyl)oxolan-3-yl] benzoate > C59H74O34 > 1327.207 > 1326.40615 > 0 > O([C@H]1O[C@@H]([C@@H](OC(=O)/C=C/C2=CC(OC)=C(O)C=C2)[C@H](O[C@H]3O[C@@H]([C@@H](O)[C@H](O[C@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO)[C@H]3O)COC(=O)C)[C@H]1O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)CO)CO)[C@@]6(O[C@@H]([C@@H](O)[C@@H]6OC(=O)C7=CC=CC=C7)CO)COC(=O)/C=C/C8=CC(OC)=C(O)C=C8 > InChI=1S/C59H74O34/c1-25(64)81-23-37-42(71)50(88-55-46(75)44(73)40(69)33(19-60)83-55)48(77)57(86-37)89-51-49(87-39(68)16-12-27-10-14-30(66)32(18-27)80-3)36(22-63)85-58(52(51)90-56-47(76)45(74)41(70)34(20-61)84-56)93-59(24-82-38(67)15-11-26-9-13-29(65)31(17-26)79-2)53(43(72)35(21-62)92-59)91-54(78)28-7-5-4-6-8-28/h4-18,33-37,40-53,55-58,60-63,65-66,69-77H,19-24H2,1-3H3/b15-11+,16-12+/t33-,34-,35-,36-,37-,40-,41-,42-,43-,44+,45+,46-,47-,48-,49-,50+,51+,52-,53+,55-,56+,57-,58-,59+/m1/s1 > QPMDXYWECMAJNN-XWKGHZHVSA-N $$$$