科华智慧（深圳）创新药物研发有限公司-天然产物化合物库-创新药物研发-波谱智能解析-化合物冷冻电镜结构解析

天然产物数据库

您可快速检索70万⁺天然产物信息

检索最多: 白僵菌素大品种冬虫夏草人参三七党参大戟决明半夏丁香

CAS No.	英文名/中文名/SMILES	分子式	分子量
-	4-[2-(3-Benzenesulfonylamino-5-methyl-phenoxy)-ethylamino]-pyridinium - CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)NS(=O)(=O)C3=CC=CC=C3	C₂₀H₂₁N₃O₃S	383.5
-	(S)-4,5-dihydro-3-[(1z,7z)-hexadecan-7-enylidene]-4-hydroxy-5-methylenefuran-2(3h)-one - CCCCCCCC/C=C\CCCCC/C=C\1/[C@@H](C(=C)OC1=O)O	C₂₁H₃₄O₃	334.5
-	9-Decenoylcarnitine - C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CCCCCCCC=C	C₁₇H₃₁NO₄	313.4
-	(1S,4R,6S,8S,9R)-4-methyl-13-azatetracyclo[7.7.0.01,6.02,13]hexadec-2-en-8-ol - C[C@@H]1C[C@H]2C[C@@H]([C@H]3[C@]24CCCN(C4=C1)CCC3)O	C₁₆H₂₅NO	247.38
-	[(2R,3S)-2-[(3S)-3-[(E,3R,4S)-3,4-diacetyloxypent-1-enyl]oxiran-2-yl]-6-oxo-2,3-dihydropyran-3-yl] acetate - C[C@@H]([C@@H](/C=C/[C@H]1C(O1)[C@H]2[C@H](C=CC(=O)O2)OC(=O)C)OC(=O)C)OC(=O)C	C₁₈H₂₂O₉	382.4
-	Cineroctine - CC/C=C/C(CC(=O)O[C@H]1CCN2C[C@H]3C[C@H]([C@@H]2C1)CN4C3CCCC4=O)O	C₂₂H₃₄N₂O₄	390.5
-	N-[[(1S,4S,6S)-3-methyl-4-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]propan-2-amine - CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C(C)C)CNC(C)C	C₂₃H₃₂N₄O₃	412.5
-	Methyl 4,8-dihydroxyquinoline-2-carboxylate - COC(=O)C1=CC(=O)C2=C(N1)C(=CC=C2)O	C₁₁H₉NO₄	219.19
-	1-Linoleoyl-2-docosadienoyl-3-eicsoatetraenoyl-glycerol - CCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCC/C=C\C/C=C\C/C=C\C/C=C\CC	C₆₃H₁₀₆O₆	959.5
-	[(1S,4aS,10aR)-1,4a,7-trimethyl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanol - CC1=CC2=C(C=C1)[C@]3(CCC[C@]([C@@H]3CC2)(C)CO)C	C₁₈H₂₆O	258.4