LMPR01070542 LIPID_MAPS_STRUCTURE_DATABASE 53 54 0 0 0 999 V2000 13.7732 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7732 -15.8278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6270 -16.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4808 -15.8278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4808 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6270 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3523 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2061 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0599 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9138 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7676 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6213 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4751 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3290 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1827 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0366 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8903 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7442 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.5981 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.4518 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.3056 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1594 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.0132 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.8669 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.7208 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.5747 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.4284 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2822 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.1360 -14.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.9899 -14.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0599 -13.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4751 -13.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7442 -15.8278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1594 -15.8278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.5747 -15.8278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.8549 -14.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.9901 -16.3632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3260 -16.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.8448 -15.3354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9062 -16.3283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1261 -13.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1278 -13.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2277 -16.5669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 33.3739 -17.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3739 -18.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2277 -18.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.0815 -18.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.0815 -17.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.9354 -18.5388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 34.2277 -19.5248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 32.5200 -18.5388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 32.5200 -16.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.6662 -17.0599 0.0000 O 0 0 0 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 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 1 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 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 2 0 0 0 0 12 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 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 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 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 9 31 1 0 0 0 0 13 32 1 0 0 0 0 18 33 1 0 0 0 0 22 34 1 0 0 0 0 26 35 1 0 0 0 0 30 36 1 0 0 0 0 30 37 1 0 0 0 0 4 38 1 0 0 0 0 30 39 1 0 0 0 0 2 40 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 43 44 1 0 0 0 0 43 48 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 6 0 0 0 46 50 1 1 0 0 0 45 51 1 6 0 0 0 44 52 1 1 0 0 0 52 53 1 0 0 0 0 48 37 1 1 0 0 0 M END > LMPR01070542 > 1',2'-Dihydro-3,1'-dihydroxytorulene glucoside > 1'-Glucosyloxy-3',4'-didehydro-1',2'-dihydro-beta,psi-caroten-3-ol > C46H66O7 > 730.48 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > RPYWOLOXAHTZJG-RFFSVHAKSA-N > InChI=1S/C46H66O7/c1-32(17-11-12-18-33(2)20-15-24-36(5)26-27-39-37(6)29-38(48)30-45(39,7)8)19-13-21-34(3)22-14-23-35(4)25-16-28-46(9,10)53-44-43(51)42(50)41(49)40(31-47)52-44/h11-27,38,40-44,47-51H,28-31H2,1-10H3/b12-11+,19-13+,20-15+,22-14+,25-16+,27-26+,32-17+,33-18+,34-21+,35-23+,36-24+/t38?,40-,41-,42+,43-,44+/m1/s1 > C1C(C)(C)C(/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C/CC(C)(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C)=C(C)CC1O > - > - > - > - > - > - > 163082220 > - > - > - > - > - > 56 > 5099150 $$$$