LMPK12112640 LIPID_MAPS_STRUCTURE_DATABASE 53 58 0 0 0 0 0 0 0 0999 V2000 14.6859 13.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7949 13.7018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7949 14.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6859 15.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5768 14.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5768 13.7018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9039 13.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0129 13.7018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1221 13.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1221 12.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0129 11.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9039 12.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2310 13.7018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 13.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 12.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2310 11.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0129 10.8224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4491 13.7018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7949 11.6441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2310 10.8230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4677 15.2449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6859 16.2738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5596 13.1881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5768 16.7882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0404 9.9233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8056 8.1532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5121 10.3519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0576 7.8303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4674 10.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0555 9.9041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4826 9.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5306 9.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7529 8.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1639 9.7786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6861 7.6899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1796 8.1539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5637 9.0865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5328 9.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7732 8.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9378 7.5178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6016 7.0754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3586 6.4402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0266 7.6439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8498 5.8453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7044 4.2382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8962 6.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3012 3.6137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4695 6.9336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4539 6.8404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8653 5.9383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2927 5.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3082 5.2281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7355 4.4246 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 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 1 0 0 0 0 18 23 1 0 0 0 0 22 24 1 0 0 0 0 32 27 1 0 0 0 32 31 1 0 0 0 27 29 1 0 0 0 31 30 1 0 0 0 29 30 1 0 0 0 32 33 1 6 0 0 33 28 1 0 0 0 30 25 1 6 0 0 31 26 1 1 0 0 40 36 1 0 0 0 40 39 1 0 0 0 36 37 1 0 0 0 39 38 1 0 0 0 37 38 1 0 0 0 37 25 1 1 0 0 38 34 1 6 0 0 39 35 1 6 0 0 39 41 1 1 0 0 41 42 1 0 0 0 47 53 1 0 0 0 52 46 1 0 0 0 46 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 1 0 0 48 28 1 1 0 0 49 43 1 6 0 0 50 44 1 1 0 0 51 45 1 6 0 0 29 19 1 1 0 0 M END > LMPK12112640 > Retamatrioside > > C33H40O20 > 756.21 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > Rhamnazin 3-glucosyl-(1->5)-[apiosyl-(1->2)-alpha-L-arabinofuranoside] > KVSUVYZMSXVWNS-WDCCEDGVSA-N > InChI=1S/C33H40O20/c1-45-13-6-15(37)20-17(7-13)49-26(12-3-4-14(36)16(5-12)46-2)27(23(20)40)52-31-28(53-32-29(43)33(44,10-35)11-48-32)22(39)19(51-31)9-47-30-25(42)24(41)21(38)18(8-34)50-30/h3-7,18-19,21-22,24-25,28-32,34-39,41-44H,8-11H2,1-2H3/t18-,19+,21-,22+,24+,25-,28-,29+,30-,31+,32+,33-/m1/s1 > C1C=C(O)C(OC)=CC=1C1=C(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@](CO)(O)CO3)[C@@H](O)[C@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)O2)C(=O)C2C(O)=CC(OC)=CC=2O1 > - > - > - > - > - > - > 178336242 > - > - > - > - > - > 33090; 49838 > 10691719 $$$$