Mrv1652309082214472D 38 44 0 0 1 0 999 V2000 3.0931 4.4482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3629 3.6685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1729 3.5123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8225 3.0451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0923 2.2654 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6665 1.8562 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8347 0.8473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7138 0.5747 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2239 -0.0891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1987 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0424 -0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4463 0.7641 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0807 0.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1469 1.2996 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9018 0.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0762 0.1604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8969 0.0770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2298 0.8319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6148 1.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0679 2.2019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 2.6697 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5922 3.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0744 4.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4074 3.5666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 2.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8804 1.2999 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1255 1.3542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4436 0.9817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8305 1.3711 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7877 0.5472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0081 0.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8665 0.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 1.5557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 2.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2145 2.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0355 3.0868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 2.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4217 2.8403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 5 4 1 1 0 0 0 5 6 1 0 0 0 0 6 7 1 1 0 0 0 7 8 1 0 0 0 0 8 9 1 1 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 1 0 0 0 12 14 1 0 0 0 0 14 15 1 1 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 15 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 1 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 21 25 1 0 0 0 0 26 25 1 6 0 0 0 12 26 1 0 0 0 0 26 27 1 0 0 0 0 8 27 1 0 0 0 0 27 28 1 1 0 0 0 28 29 1 0 0 0 0 5 29 1 0 0 0 0 29 30 1 1 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 33 34 1 0 0 0 0 6 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 27 37 1 0 0 0 0 5 37 1 0 0 0 0 37 38 1 1 0 0 0 21 38 1 0 0 0 0 M END > NP0267861 > NP-MRD > CC(C)[C@]12C[C@H]3[C@]45O[C@]6(O)C(C)=CC(C)(C)[C@H](O[C@@]4(O)CC[C@@]3(C)[C@@H](O1)C1=CC=CO1)[C@]6(OC(C)=O)[C@H]5O2 > InChI=1S/C29H38O9/c1-15(2)25-14-19-24(7,20(35-25)18-9-8-12-33-18)10-11-26(31)27(19)22(36-25)28(34-17(4)30)21(37-26)23(5,6)13-16(3)29(28,32)38-27/h8-9,12-13,15,19-22,31-32H,10-11,14H2,1-7H3/t19-,20+,21+,22+,24-,25-,26+,27-,28+,29-/m1/s1 > HNHSTMBFHBATJM-WMYUKEFXSA-N > C29H38O9 > 530.614 > 530.251582804 > 7 > 76 > 55.62478616095948 > 1 > 2 > 0 > 0 > (1S,2S,3R,7S,9S,12R,13R,15S,17R,18R)-13-(furan-2-yl)-3,9-dihydroxy-4,6,6,12-tetramethyl-15-(propan-2-yl)-8,14,19,20-tetraoxahexacyclo[13.3.1.1^{3,18}.0^{2,7}.0^{9,18}.0^{12,17}]icos-4-en-2-yl acetate > 3.9375233196666652 > 0 > 7 > 0 > 10.977711137456122 > 10.168250011763005 > -2.8780842775033206 > 116.82000000000002 > 132.1993 > 4 > 0 > (1S,2S,3R,7S,9S,12R,13R,15S,17R,18R)-13-(furan-2-yl)-3,9-dihydroxy-15-isopropyl-4,6,6,12-tetramethyl-8,14,19,20-tetraoxahexacyclo[13.3.1.1^{3,18}.0^{2,7}.0^{9,18}.0^{12,17}]icos-4-en-2-yl acetate > 0 > NP0267861 > (1s,2s,3r,7s,9s,12r,13r,15r,17r,18r)-13-(furan-2-yl)-3,9-dihydroxy-15-isopropyl-4,6,6,12-tetramethyl-8,14,19,20-tetraoxahexacyclo[13.3.1.1³,¹⁸.0²,⁷.0⁹,¹⁸.0¹²,¹⁷]icos-4-en-2-yl acetate $$$$