Mrv1652309062200362D 38 44 0 0 1 0 999 V2000 3.9063 2.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4383 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2612 1.6554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6964 2.3563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5724 0.8914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9418 0.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 0.7946 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4637 0.5180 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8047 1.0143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1291 0.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3489 0.8092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3705 -0.2480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8742 -0.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1954 -0.2622 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6380 -0.9584 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2028 -1.6592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -1.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0385 -0.4600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8634 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4939 -0.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3484 0.6114 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2885 1.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5877 1.8694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0526 1.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5847 1.1149 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4040 1.2116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6723 1.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9904 0.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9024 -0.1890 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6032 -0.6242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2062 -0.6316 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1920 -1.4565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8510 -1.9528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4031 -1.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1348 -2.4780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9297 -1.0222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 -0.3632 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1494 0.4140 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 7 6 1 6 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 6 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 14 12 1 1 0 0 0 8 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 1 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 6 1 6 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 5 1 6 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 24 1 1 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 1 0 0 0 29 31 1 0 0 0 0 31 32 1 1 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 37 36 1 6 0 0 0 31 37 1 0 0 0 0 38 37 1 1 0 0 0 25 38 1 0 0 0 0 21 38 1 0 0 0 0 M END > NP0221112 > NP-MRD > O[C@@H]1C[C@H]2CC[C@@]3([C@@H]4[C@H]5OC(=O)C(=C)[C@@H]5[C@H](O)CC(=C)[C@@H]4CC3=O)C3=C2[C@H]([C@H]2OC(=O)C(=C)[C@H]12)C(=C)C3=O > InChI=1S/C30H30O8/c1-10-7-16(31)20-13(4)29(36)38-27(20)23-15(10)9-18(33)30(23)6-5-14-8-17(32)19-12(3)28(35)37-26(19)21-11(2)25(34)24(30)22(14)21/h14-17,19-21,23,26-27,31-32H,1-9H2/t14-,15+,16-,17-,19-,20-,21-,23+,26+,27+,30-/m1/s1 > XZUWIBKUNURJFV-KTJRIKHPSA-N > C30H30O8 > 518.562 > 518.194067926 > 6 > 68 > 52.99717501329381 > 1 > 2 > 0 > 0 > (1'S,2'R,3aR,4R,6'R,6aR,7'R,9R,9'R,9aR,9bR)-4,7'-dihydroxy-3,5',6,15'-tetramethylidene-3,3a,4,5,6,6a,7,8,9a,9b-decahydro-2H-3'-oxaspiro[azuleno[4,5-b]furan-9,12'-tetracyclo[7.6.1.0^{2,6}.0^{13,16}]hexadecan]-13'(16')-ene-2,4',8,14'-tetrone > 1.654085873000001 > 0 > 7 > 0 > 15.039077055851273 > 14.435721464991367 > -2.903200402050345 > 127.20000000000003 > 133.76809999999998 > 0 > 0 > (1'S,2'R,3aR,4R,6'R,6aR,7'R,9R,9'R,9aR,9bR)-4,7'-dihydroxy-3,5',6,15'-tetramethylidene-4,5,6a,7,9a,9b-hexahydro-3aH-3'-oxaspiro[azuleno[4,5-b]furan-9,12'-tetracyclo[7.6.1.0^{2,6}.0^{13,16}]hexadecan]-13'(16')-ene-2,4',8,14'-tetrone > 0 > NP0221112 > (1's,2'r,3ar,4r,6'r,6ar,7'r,9r,9'r,9ar,9br)-4,7'-dihydroxy-3,5',6,15'-tetramethylidene-4,5,6a,7,9a,9b-hexahydro-3ah-3'-oxaspiro[azuleno[4,5-b]furan-9,12'-tetracyclo[7.6.1.0²,⁶.0¹³,¹⁶]hexadecan]-13'(16')-ene-2,4',8,14'-tetrone $$$$