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
-	bitalin A-12-O-beta-D-glucopyranoside - CC(=O)C1=CC2=C(C=C1)O[C@@H](C2)C(=C)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O	C₁₉H₂₄O₈	380.4
-	3-[[(3R,4aR,6S,6aS,10aS)-3-ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-6-yl]oxy]-3-oxopropanoic acid - C[C@@]1(CCC2[C@]3(CCCC([C@@H]3[C@H](C[C@]2(O1)C)OC(=O)CC(=O)O)(C)C)C)C=C	C₂₃H₃₆O₅	392.5
-	[(3R,3aR,6aR,9S,9aR,9bR)-3-hydroxy-9-methyl-6-methylidene-2,8-dioxo-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-3-yl]methyl acetate - C[C@H]1[C@H]2[C@@H](CC1=O)C(=C)CC[C@@H]3[C@@H]2OC(=O)[C@@]3(COC(=O)C)O	C₁₇H₂₂O₆	322.4
-	(2R)-2-[[(2S,4R,5S,6R)-4,5-dihydroxy-6-[(E)-2-phenylethenyl]oxan-2-yl]methyl]-2,3-dihydropyran-6-one - C1C=CC(=O)O[C@H]1C[C@@H]2C[C@H]([C@@H]([C@H](O2)/C=C/C3=CC=CC=C3)O)O	C₁₉H₂₂O₅	330.4
-	(2S)-2-(hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol - C1CN2CCC1C([C@@H]2CO)(O)O	C₈H₁₅NO₃	173.21
-	Dynorphin B (6-9) - C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)[C@@H](CCC(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCCN=C(N)N)N	C₂₆H₄₃N₁₁O₆	605.7
-	1-Myristoleoyl-2-stearidonoyl-3-erucoyl-glycerol - CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\CCCC)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC	C₅₇H₉₈O₆	879.4
77881-13-1	(17alpha)-17-Hydroxy-3-oxoandrost-4-ene-17-carbonitrile - C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]4(C#N)O)C	C₂₀H₂₇NO₂	313.4
-	methyl (2S,3S)-2-hydroxy-3-phenoxy-3-phenylpropanoate - COC(=O)[C@H]([C@H](C1=CC=CC=C1)OC2=CC=CC=C2)O	C₁₆H₁₆O₄	272.29
-	Penicacid G - CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/[C@H](CC(=O)OC)O)O	C₁₈H₂₂O₇	350.4