Mrv1652309032209332D 37 41 0 0 1 0 999 V2000 5.3298 -1.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9433 -1.2017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7724 -0.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3859 0.1570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1703 -0.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2150 0.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4306 1.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2597 2.0267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8732 2.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7023 3.3854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6576 2.3227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8171 0.6680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -0.1391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2732 -0.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6605 0.0015 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9967 0.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4097 1.4691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5123 1.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6917 1.3371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3556 0.5837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -0.0841 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3244 -0.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5038 -0.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6833 -0.9231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1989 -0.2553 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3783 -0.3409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6051 -1.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3635 -0.7020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1061 0.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9266 0.2413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 0.9091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2316 0.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0749 1.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2301 1.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0506 1.1659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 0.4981 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8712 1.2515 0.0000 C 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 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 7 12 1 0 0 0 0 12 13 2 0 0 0 0 3 13 1 0 0 0 0 13 14 1 0 0 0 0 15 14 1 1 0 0 0 15 16 1 0 0 0 0 12 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 6 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 25 24 1 1 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 29 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 20 36 1 0 0 0 0 25 36 1 0 0 0 0 36 37 1 6 0 0 0 M END > NP0171161 > NP-MRD > COC1=C(C)C=C(OC(C)=O)C2=C1C[C@@H]1C2(C)CCC2[C@]1(C)CC[C@H]1C(C)(C)C(CC[C@@]21C)OC(C)=O > InChI=1S/C32H46O5/c1-18-16-22(36-19(2)33)27-21(28(18)35-9)17-25-31(7)13-10-23-29(4,5)26(37-20(3)34)12-15-30(23,6)24(31)11-14-32(25,27)8/h16,23-26H,10-15,17H2,1-9H3/t23-,24?,25-,26?,30+,31-,32?/m0/s1 > QXFYOHJPYUBNJR-RKBNJOQYSA-N > C32H46O5 > 510.715 > 510.334524581 > 3 > 83 > 59.930374309658376 > 0 > 0 > 0 > 0 > (1S,2S,14S,19R)-17-(acetyloxy)-5-methoxy-1,6,10,14,18,18-hexamethylpentacyclo[11.8.0.0^{2,10}.0^{4,9}.0^{14,19}]henicosa-4(9),5,7-trien-8-yl acetate > 6.65 > 6.639813234666668 > -7.15 > 0 > 5 > 0 > -4.80948815162365 > 61.830000000000005 > 144.183 > 5 > 0 > 3.62e-05 g/l > (1S,2S,14S,19R)-17-(acetyloxy)-5-methoxy-1,6,10,14,18,18-hexamethylpentacyclo[11.8.0.0^{2,10}.0^{4,9}.0^{14,19}]henicosa-4(9),5,7-trien-8-yl acetate > 0 > NP0171161 > (4as,11as,11bs,13ar)-2-(acetyloxy)-10-methoxy-1,1,4a,6a,9,11b-hexamethyl-2h,3h,4h,4bh,5h,6h,11h,11ah,12h,13h,13ah-indeno[2,1-a]phenanthren-7-yl acetate $$$$