Mrv0541 02251511532D 57 58 0 0 1 0 999 V2000 14.0538 -4.1827 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.0538 -5.0077 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3393 -3.7702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3393 -5.4202 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6249 -4.1827 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6249 -5.0077 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.7683 -3.7702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7683 -5.4202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3393 -6.2452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9104 -5.4202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9104 -3.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1959 -4.1827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7683 -2.9452 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.4829 -2.5327 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.0539 -2.5326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4829 -1.7077 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.0539 -1.7076 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.7684 -1.2952 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.1973 -2.9452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1973 -1.2952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7684 -0.4702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3395 -1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3395 -0.4701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9118 -2.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6263 -2.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3407 -2.5328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0552 -2.9453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7696 -2.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4841 -2.9454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1986 -2.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9131 -2.9454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9130 -3.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1985 -4.1829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4841 -3.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7696 -4.1828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0551 -3.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3407 -4.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6262 -3.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9117 -4.1826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9118 -1.7077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1973 -0.4702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9119 -0.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6263 -0.4702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4829 -0.0576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3408 -0.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0553 1.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7698 0.7672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4842 1.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1987 0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9132 1.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6277 0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6276 -0.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9131 -0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1987 -0.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4842 -0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7697 -0.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0553 -0.4702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 1 7 1 6 0 0 0 2 8 1 6 0 0 0 4 9 1 1 0 0 0 6 10 1 6 0 0 0 5 11 1 1 0 0 0 12 11 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 18 1 0 0 0 0 13 7 1 1 0 0 0 14 19 1 1 0 0 0 16 20 1 6 0 0 0 18 21 1 1 0 0 0 17 22 1 6 0 0 0 23 22 1 0 0 0 0 19 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 24 40 2 0 0 0 0 20 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 41 44 2 0 0 0 0 43 45 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 45 1 0 0 0 0 M END > CHEBI:84042 > 2,3-dipalmitoyl-alpha,alpha-trehalose > A polyacyl α,α-trehalose carrying two palmitoyl (hexadecanoyl) substituents that are located at positions 2 and 3. > 3 > alpha,alpha-trehalose 2,3-dipalmitate; alpha,alpha-trehalose 2,3-dihexadecanoate; 2-O,3-O-dihexadecanoyl-alpha,alpha-trehalose; 2,3-dihexadecanoyl-alpha,alpha-trehalose > 2,3-di-O-hexadecanoyl-alpha-D-glucopyranosyl alpha-D-glucopyranoside > C44H82O13 > 819.11410 > 818.57554 > 0 > CCCCCCCCCCCCCCCC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1OC(=O)CCCCCCCCCCCCCCC > InChI=1S/C44H82O13/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-35(47)55-41-38(50)34(32-46)54-44(57-43-40(52)39(51)37(49)33(31-45)53-43)42(41)56-36(48)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34,37-46,49-52H,3-32H2,1-2H3/t33-,34-,37-,38-,39+,40-,41+,42-,43-,44-/m1/s1 > QOSPBHQULZCYBI-RPWXKBNISA-N > 6170086 > 19276083 $$$$