Mrv0541 01151414332D 101111 0 0 0 0 999 V2000 10.5948 -3.9736 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6073 -3.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8823 -4.3777 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4366 -8.0735 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0406 -3.1652 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8907 -5.6360 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4573 -4.3777 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1824 -6.8569 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.4656 -9.7527 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.1781 -3.5736 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.3239 -2.7361 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1615 -7.6819 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.1781 -8.5152 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.4656 -10.5776 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8822 -3.1569 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1656 -3.9611 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4573 -5.2027 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.8864 -7.2694 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.8906 -8.0985 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7407 -5.6110 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7489 -3.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6741 -10.1193 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.5989 -3.5736 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.7531 -10.9901 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6907 -9.2943 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5990 -5.2110 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9074 -6.4610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1697 -6.8694 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1697 -4.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1822 -9.3402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4157 -8.8985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7531 -9.3402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -6.4277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4573 -7.2819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4614 -3.1611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7324 -7.6444 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.5989 -4.4027 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8822 -4.8111 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1699 -5.2360 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0406 -10.5776 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.4614 -8.1027 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8906 -2.7236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9449 -10.5110 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0365 -5.2027 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7532 -6.8194 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0406 -9.7527 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9907 -8.8652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5865 -4.3861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3198 -5.6152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3031 -4.3944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8823 -5.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1698 -3.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0281 -3.9902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7448 -3.9611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1698 -5.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7656 -2.7611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1574 -4.4069 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2407 -10.0818 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.3323 -1.9028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1614 -6.0444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8781 -5.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7489 -4.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8657 -3.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2657 -9.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0614 -1.5028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0365 -4.3777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8657 -8.1110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8822 -2.3361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1822 -10.9901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5947 -6.8485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3782 -10.5485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6072 -8.5027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3156 -3.1652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7531 -11.8110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7781 -1.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0074 -8.0402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3114 -4.8152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4699 -5.6569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3239 -10.9901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9241 -11.3360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3282 -6.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5865 -4.7986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8740 -3.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 -3.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1490 -6.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4324 -4.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5199 -10.4735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7489 -8.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5032 -6.3152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0323 -8.1110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3239 -9.3402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0491 -6.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6448 -0.7861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4739 -0.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4614 -8.9235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7407 -4.7861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1615 -4.7861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3156 -3.5611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6824 -8.4652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1823 -4.6236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1782 -6.0485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 12 1 0 0 0 0 5 53 1 0 0 0 0 6 26 1 0 0 0 0 7 16 1 0 0 0 0 8 27 1 1 0 0 0 9 30 1 0 0 0 0 10 35 1 1 0 0 0 11 2 1 0 0 0 0 12 8 1 0 0 0 0 13 19 1 0 0 0 0 14 9 1 0 0 0 0 15 10 1 0 0 0 0 16 3 1 0 0 0 0 17 7 1 0 0 0 0 18 28 1 0 0 0 0 19 18 1 0 0 0 0 20 17 1 0 0 0 0 5 21 1 1 0 0 0 22 25 1 0 0 0 0 23 15 1 0 0 0 0 24 14 1 0 0 0 0 25 31 1 0 0 0 0 26 49 1 0 0 0 0 27 6 1 0 0 0 0 28 60 1 1 0 0 0 29 10 1 0 0 0 0 13 30 1 6 0 0 0 4 31 1 6 0 0 0 32 9 1 0 0 0 0 33 8 1 0 0 0 0 34 28 1 0 0 0 0 35 21 1 0 0 0 0 36 45 1 0 0 0 0 37 38 1 0 0 0 0 38 29 1 0 0 0 0 39 6 1 0 0 0 0 40 46 1 0 0 0 0 41 34 1 0 0 0 0 42 2 2 0 0 0 0 43 22 1 0 0 0 0 44 20 1 0 0 0 0 45 33 1 0 0 0 0 46 32 1 0 0 0 0 47 25 1 0 0 0 0 48 26 1 0 0 0 0 44 49 1 1 0 0 0 50 1 1 0 0 0 0 51 3 1 0 0 0 0 52 42 1 0 0 0 0 53 50 1 0 0 0 0 54 7 1 0 0 0 0 55 51 1 0 0 0 0 56 5 1 0 0 0 0 57 63 1 0 0 0 0 58 43 1 0 0 0 0 59 11 1 0 0 0 0 60 61 1 0 0 0 0 38 61 1 1 0 0 0 62 21 2 0 0 0 0 63 48 1 0 0 0 0 64 47 1 0 0 0 0 65 59 1 0 0 0 0 66 54 1 0 0 0 0 12 67 1 6 0 0 0 15 68 1 6 0 0 0 14 69 1 6 0 0 0 18 70 1 6 0 0 0 22 71 1 6 0 0 0 19 72 1 1 0 0 0 23 73 1 1 0 0 0 24 74 1 6 0 0 0 75 56 1 0 0 0 0 36 76 1 1 0 0 0 37 77 1 6 0 0 0 39 78 1 1 0 0 0 40 79 1 1 0 0 0 43 80 1 1 0 0 0 81 20 1 0 0 0 0 1 82 1 6 0 0 0 3 83 1 1 0 0 0 7 84 1 1 0 0 0 20 85 1 1 0 0 0 57 86 1 1 0 0 0 58 87 1 6 0 0 0 41 88 1 1 0 0 0 89 81 1 0 0 0 0 90 88 1 0 0 0 0 46 91 1 6 0 0 0 45 92 1 6 0 0 0 93 65 1 0 0 0 0 94 65 1 0 0 0 0 9 95 1 6 0 0 0 17 96 1 6 0 0 0 16 97 1 6 0 0 0 11 98 1 1 0 0 0 25 99 1 6 0 0 0 26100 1 6 0 0 0 6101 1 1 0 0 0 5 11 1 0 0 0 0 52 16 1 0 0 0 0 55 17 1 0 0 0 0 65 75 1 0 0 0 0 44 66 1 0 0 0 0 23 37 1 0 0 0 0 57 39 1 0 0 0 0 13 41 1 0 0 0 0 36 4 1 0 0 0 0 58 64 1 0 0 0 0 40 24 1 0 0 0 0 M END > CHEBI:69373 > sieboldianoside A > A triterpenoid saponin with hederagenin as the aglycone part. It has been isolated from the stem bark of Kalopanax pictus. > 3 > kalopanaxsaponin H; 3-O-[beta-D-xylopyranosyl-(1->3)-alpha-L-rhamnopyranosyl-(1->2)-alpha-L-arabinosyl]-hederagenin-28-O-[alpha-L-rhamnopyranosyl-(1->4)-beta-D-glucopyranosyl (1->6)-beta-D-glucopyranoside] > 6-deoxy-alpha-L-mannopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->6)-1-O-[(3beta)-23-hydroxy-28-oxo-3-{[beta-D-xylopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->2)-alpha-L-arabinopyranosyl]oxy}olean-12-en-28-yl]-beta-D-glucopyranose > C64H104O30 > 1353.49260 > 1352.66124 > 0 > C[C@@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O > InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38-,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1 > PLQZZVHULIUSEV-IZTHVZRKSA-N > 6631122 > 21870831; 7764238 $$$$