Mrv1533004241502232D 35 41 0 0 0 0 999 V2000 -0.3880 -2.6431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4285 -2.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0345 -1.5027 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4616 -0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8083 -0.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0325 0.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 0.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8724 1.0572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 0.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1115 1.0940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3457 1.9419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1785 -0.4499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5091 -0.3588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4354 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -1.6762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2996 -1.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7587 -2.3045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6636 -0.8788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4471 -1.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4655 -2.5216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2204 -2.8584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -2.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3863 -1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2454 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8655 -0.9696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7324 -1.0749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3680 -0.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5662 -0.1437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7221 0.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -0.0456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6347 0.8538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4704 -0.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1102 0.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 0.7039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8674 -1.4201 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 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 10 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 5 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 14 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 19 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 12 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 23 32 1 0 0 0 0 32 33 1 0 0 0 0 28 33 1 0 0 0 0 33 34 1 0 0 0 0 19 35 1 0 0 0 0 3 35 1 0 0 0 0 12 35 1 0 0 0 0 M END > NP0186430 > NP-MRD > CCN1CC2(C)CCC(OC)C34C2C(OC(C)=O)C2(OCOC22CC(OC)C5CC3(O)C2C5O)C14 > InChI=1S/C26H39NO8/c1-6-27-11-22(3)8-7-16(32-5)25-19(22)20(35-13(2)28)26(21(25)27)24(33-12-34-26)10-15(31-4)14-9-23(25,30)18(24)17(14)29/h14-21,29-30H,6-12H2,1-5H3 > AIICBVJTYIFTLW-UHFFFAOYSA-N > C26H39NO8 > 493.597 > 493.26756722 > 8 > 74 > 51.67105592222223 > 1 > 2 > 0 > 0 > 14-ethyl-2,4-dihydroxy-6,19-dimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.1²,⁵.0¹,¹³.0³,⁸.0⁸,¹².0¹⁶,²⁰]docosan-21-yl acetate > 1.06 > -0.6727581709999989 > -2.08 > 0 > 7 > 1 > 14.626287128570219 > 13.739985712888231 > 9.372792112060328 > 106.92000000000002 > 121.6996 > 5 > 1 > 4.08e+00 g/l > 14-ethyl-2,4-dihydroxy-6,19-dimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.1²,⁵.0¹,¹³.0³,⁸.0⁸,¹².0¹⁶,²⁰]docosan-21-yl acetate > 0 > NP0186430 > 14-ethyl-2,4-dihydroxy-6,19-dimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.1²,⁵.0¹,¹³.0³,⁸.0⁸,¹².0¹⁶,²⁰]docosan-21-yl acetate $$$$