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
-	(1S,2S,5R,6R,10R,13R,15S)-5-[(Z,2S,5R)-5,6-dimethylhept-3-en-2-yl]-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadeca-8,18-dien-13-ol - C[C@@H](/C=C\[C@H](C)C(C)C)[C@H]1CC[C@H]2[C@@]1(CC=C3[C@]24C=C[C@@]5([C@@]3(CC[C@H](C5)O)C)OO4)C	C₂₈H₄₂O₃	426.6
-	N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(pyrimidin-2-ylamino)ethyl]-L-valinamide - CC(C)[C@@H](C(=O)NCCNC1=NC=CC=N1)NC2=CC=C3C(=CC2=O)[C@H](CCC4=CC(=C(C(=C43)OC)OC)OC)NC(=O)C	C₃₂H₄₀N₆O₆	604.7
-	(1R,3S,12R,14R,22R,23R,25Z,28R)-23-[6-[(1S)-cyclopent-2-en-1-yl]hexyl]-22-(4-hydroxyphenyl)hexacyclo[18.8.2.01,14.03,12.05,10.017,29]triaconta-4,6,8,10,15,17(29),18,20(30),25-nonaene-28-carboxylic acid - C1C[C@@H](C=C1)CCCCCC[C@@H]2C/C=C\C[C@H]([C@@]34C[C@@H]5C=C6C=CC=CC6=C[C@@H]5C[C@@H]3C=CC7=C4C=C(C[C@H]2C8=CC=C(C=C8)O)C=C7)C(=O)O	C₄₈H₅₄O₃	678.9
-	(6S)-14-methyl-9-(1,2-oxazole-5-carbonyl)-4-oxa-2,9-diazatricyclo[9.4.0.02,6]pentadeca-1(11),12,14-trien-3-one - CC1=CC2=C(CN(CC[C@@H]3N2C(=O)OC3)C(=O)C4=CC=NO4)C=C1	C₁₇H₁₇N₃O₄	327.33
-	N-[4-[(R)-[(3R)-4-(2-ethoxyethyl)-5-oxomorpholin-3-yl]-hydroxymethyl]phenyl]pyridine-3-carboxamide - CCOCCN1[C@H](COCC1=O)[C@@H](C2=CC=C(C=C2)NC(=O)C3=CN=CC=C3)O	C₂₁H₂₅N₃O₅	399.4
-	potassium;(2S,5R)-6-[(4R)-2,2-dimethyl-5-oxo-4-phenylimidazolidin-1-yl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - CC1([C@@H](N2[C@H](S1)C(C2=O)N3C(=O)[C@H](NC3(C)C)C4=CC=CC=C4)C(=O)[O-])C.[K+]	C₁₉H₂₂KN₃O₄S	427.6
-	(1R,7Z,11S)-16-hydroxy-7,11-dimethyl-12-oxatetracyclo[9.7.1.05,19.013,18]nonadeca-5(19),7,13(18),14,16-pentaen-3-one - C/C/1=C/CC[C@]2(C3=C(C1)CC(=O)C[C@@H]3C4=C(O2)C=CC(=C4)O)C	C₂₀H₂₂O₃	310.4
-	(6aS)-11-hydroxy-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-1-olate - C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)[O-])OC)C	C₂₀H₂₃NO₄	341.4
-	(3R,5S,8S,9R,10S,13S,14S)-3-azido-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one - C[C@]12CC[C@H](C[C@@H]1CC[C@H]3[C@H]2CC[C@]4([C@H]3CCC4=O)C)N=[N+]=[N-]	C₁₉H₂₉N₃O	315.5
-	Trideca-1,11-diene - CC=CCCCCCCCCC=C	C₁₃H₂₄	180.33