Mrv1533004241505352D 23 26 0 0 0 0 999 V2000 2.4640 -3.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1029 -2.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -2.8669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8181 -3.5505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0049 -3.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4668 -4.1758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3659 -2.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -2.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -1.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3809 -1.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2039 -1.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6658 -0.8163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4887 -0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9507 -0.1910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8497 -1.6164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3878 -2.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5649 -2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9259 -2.9835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5916 -1.2553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5333 -2.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 -2.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4035 -2.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0442 -3.4128 0.0000 O 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 3 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 2 17 1 0 0 0 0 11 17 1 0 0 0 0 17 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 15 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 M END > NP0220031 > NP-MRD > CC1C(OC(C)=O)C2OC2C2=CC(=O)C3(CC12C)OC3(C)C=O > InChI=1S/C17H20O6/c1-8-12(21-9(2)19)14-13(22-14)10-5-11(20)17(6-15(8,10)3)16(4,7-18)23-17/h5,7-8,12-14H,6H2,1-4H3 > GSPFUBNBRPVALJ-UHFFFAOYSA-N > C17H20O6 > 320.341 > 320.125988364 > 5 > 43 > 32.182812277617465 > 1 > 0 > 0 > 1 > 3'-formyl-3',5a,6-trimethyl-3-oxo-3,5,5a,6,7,7a-hexahydro-1aH-spiro[naphtho[1,2-b]oxirene-4,2'-oxirane]-7-yl acetate > 1.62 > 0.9696229983333332 > -2.70 > 0 > 4 > 0 > 15.912445008408021 > -4.0022699322590025 > 85.5 > 78.2546 > 3 > 1 > 6.46e-01 g/l > 3'-formyl-3',5a,6-trimethyl-3-oxo-5,6,7,7a-tetrahydro-1aH-spiro[naphtho[1,2-b]oxirene-4,2'-oxirane]-7-yl acetate > 0 > NP0220031 > 3'-formyl-3,3',3a-trimethyl-6-oxo-2,3,4,7b-tetrahydro-1ah-spiro[naphtho[1,2-b]oxirene-5,2'-oxiran]-2-yl acetate $$$$