Mrv0541 05061308102D 75 82 0 0 0 0 999 V2000 -2.0939 3.3462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8985 1.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6353 -1.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6328 -0.7776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5466 1.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 0.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9943 -0.6643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4083 1.1115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 2.1564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7703 2.8077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3367 0.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5754 -0.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 1.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5533 2.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3587 1.1884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0195 -0.2889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7633 -0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 1.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2057 4.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9511 1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2834 5.4472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7879 4.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5876 2.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 0.9666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9224 1.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6739 3.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1390 1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4589 5.4204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1366 4.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1072 -0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0148 0.7029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4511 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3905 0.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8618 4.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8587 2.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9525 6.0718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3724 4.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3299 3.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7211 4.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0466 2.1594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1766 5.7915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6102 2.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8339 3.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5148 1.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2034 4.9669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4223 2.4498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5981 2.9415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7951 0.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9193 -0.3634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8269 0.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 0.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6708 0.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0596 1.6179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9254 5.2631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2314 0.3171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6725 6.1747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6421 2.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5815 4.6597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3905 2.6449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1818 6.8643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2595 5.3932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5178 3.5162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0431 4.3805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7663 2.9353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4938 6.2544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0784 1.9643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1826 2.7460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5521 4.4605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9959 4.7376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9542 3.0805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6072 0.6076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2494 3.4478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2632 0.1221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7026 1.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7109 2.1242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10 9 1 0 0 0 0 14 9 1 0 0 0 0 15 13 1 0 0 0 0 16 11 1 0 0 0 0 17 12 1 0 0 0 0 23 1 1 0 0 0 0 23 2 1 0 0 0 0 23 10 2 0 0 0 0 24 11 1 0 0 0 0 25 18 1 0 0 0 0 26 19 1 0 0 0 0 27 20 1 0 0 0 0 28 21 1 0 0 0 0 29 22 1 0 0 0 0 30 12 1 0 0 0 0 31 18 1 0 0 0 0 32 13 1 0 0 0 0 33 24 1 0 0 0 0 33 25 1 0 0 0 0 34 26 1 0 0 0 0 35 27 1 0 0 0 0 36 28 1 0 0 0 0 37 29 1 0 0 0 0 38 34 1 0 0 0 0 39 37 1 0 0 0 0 40 35 1 0 0 0 0 41 36 1 0 0 0 0 42 38 1 0 0 0 0 43 39 1 0 0 0 0 44 40 1 0 0 0 0 45 41 1 0 0 0 0 46 42 1 0 0 0 0 47 43 1 0 0 0 0 48 44 1 0 0 0 0 49 3 1 0 0 0 0 49 4 1 0 0 0 0 49 30 1 0 0 0 0 49 32 1 0 0 0 0 50 5 1 0 0 0 0 50 15 1 0 0 0 0 50 30 1 0 0 0 0 50 31 1 0 0 0 0 51 6 1 0 0 0 0 51 17 1 0 0 0 0 51 31 1 0 0 0 0 52 7 1 0 0 0 0 52 16 1 0 0 0 0 52 33 1 0 0 0 0 52 51 1 0 0 0 0 53 8 1 0 0 0 0 53 14 1 0 0 0 0 53 24 1 0 0 0 0 54 19 1 0 0 0 0 55 20 1 0 0 0 0 56 21 1 0 0 0 0 57 25 1 0 0 0 0 58 34 1 0 0 0 0 59 35 1 0 0 0 0 60 36 1 0 0 0 0 61 37 1 0 0 0 0 62 38 1 0 0 0 0 63 39 1 0 0 0 0 64 40 1 0 0 0 0 65 41 1 0 0 0 0 66 42 1 0 0 0 0 67 43 1 0 0 0 0 68 22 1 0 0 0 0 68 45 1 0 0 0 0 69 28 1 0 0 0 0 69 45 1 0 0 0 0 70 26 1 0 0 0 0 70 46 1 0 0 0 0 71 27 1 0 0 0 0 71 48 1 0 0 0 0 72 29 1 0 0 0 0 72 47 1 0 0 0 0 73 32 1 0 0 0 0 73 48 1 0 0 0 0 74 44 1 0 0 0 0 74 46 1 0 0 0 0 75 47 1 0 0 0 0 75 53 1 0 0 0 0 M END > CHEM028941 > chemdb > CC(C)=CCCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C > InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3 > JDCPEKQWFDWQLI-UHFFFAOYSA-N > C53H90O22 > 1079.2685 > 1078.592374564 > 22 > 116.19580812661134 > 0 > 14 > 0 > 0 > 2-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[2-(5-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-16-hydroxy-2,6,6,10,11-pentamethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl)-6-methylhept-5-en-2-yl]oxy}oxane-3,4,5-triol > -0.17 > -0.9210698356666672 > -3.14 > 1 > 8 > 0 > 12.185055006869234 > 11.75152596923524 > -3.6486743719488306 > 357.0600000000001 > 260.92660000000006 > 16 > 0 > 7.80e-01 g/l > 2-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[2-(5-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-16-hydroxy-2,6,6,10,11-pentamethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl)-6-methylhept-5-en-2-yl]oxy}oxane-3,4,5-triol > 0 > Ginsenoside Rc > 11021-14-0 $$$$