中文名稱:
英文名稱:N-(2-Azidoethyl)-3-oxo-lup-20(29)-en-28-amide
CAS:2055270-64-7
分子式:
C32H50N4O2
分子量:522.7650
-2.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5684 -2.3782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6448 -1.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3247 0.5863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4895 1.3992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2324 -0.1134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4343 -0.0980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1143 2.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3928 2.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3787 -0.1489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7635 0.4759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1388 -0.1393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6718 -0.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2647 -1.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7728 -3.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -4.1415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -3.9113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7752 -3.9116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -4.1352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8466 -3.2874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9203 1.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7177 3.4153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3150 4.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5361 3.7914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4291 2.8950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6586 1.8459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4001 -0.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1971 -0.5682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0519 0.8883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2549 0.8821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 2 0 0 0 0 2 31 2 0 0 0 0 3 29 1 0 0 0 0 3 37 1 0 0 0 0 3 79 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 7 22 1 6 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 8 23 1 1 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 9 39 1 1 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 10 40 1 6 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 11 41 1 6 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 12 28 1 1 0 0 0 13 19 1 0 0 0 0 13 24 1 0 0 0 0 13 29 1 1 0 0 0 14 20 1 0 0 0 0 14 26 1 0 0 0 0 14 42 1 6 0 0 0 15 19 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 27 1 0 0 0 0 21 32 1 6 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 27 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 30 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 31 1 0 0 0 0 26 33 1 0 0 0 0 26 34 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 30 31 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 32 35 1 0 0 0 0 32 36 2 0 0 0 0 33 73 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 34 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 37 38 1 0 0 0 0 37 85 1 0 0 0 0 37 86 1 0 0 0 0 38 87 1 0 0 0 0 38 88 1 0 0 0 0 M CHG 2 5 1 6 -1 M END
N-(2-Azidoethyl)-3-oxo-lup-20(29)-en-28-amide Smile 編碼: O=C([C@]12C([H])([H])C([H])([H])[C@@]([H])(C(=C([H])[H])C([H])([H])[H])[C@]1([H])[C@@]1([H])C([H])([H])C([H])([H])[C@]3([H])[C@@]4(C([H])([H])[H])C([H])([H])C([H])([H])C(C(C([H])([H])[H])(C([H])([H])[H])[C@]4([H])C([H])([H])C([H])([H])[C@@]3(C([H])([H])[H])[C@]1(C([H])([H])[H])C([H])([H])C2([H])[H])=O)N([H])C([H])([H])C([H])([H])N=[N+]=[N-]
N-(2-Azidoethyl)-3-oxo-lup-20(29)-en-28-amide InChi 編碼: 1S/C32H50N4O2/c1-20(2)21-10-15-32(27(38)34-18-19-35-36-33)17-16-30(6)22(26(21)32)8-9-24-29(5)13-12-25(37)28(3,4)23(29)11-14-31(24,30)7/h21-24,26H,1,8-19H2,2-7H3,(H,34,38)/t21-,22+,23-,24+,26+,29-,30+,31+,32-/m0/s1
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