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
-	N-{3-[(3,4-dimethoxybenzoyl)amino]propyl}-4-oxo-3,4-dihydro-2-quinazolinecarboxamide - COC1=C(C=C(C=C1)C(=O)NCCCNC(=O)C2=NC3=CC=CC=C3C(=O)N2)OC	C₂₁H₂₂N₄O₅	410.4
-	N-{6-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridin-3-yl}acetamide - CC(=O)NC1=CN=C(C=C1)N2C[C@H]3C[C@@H](C2)C4=CC=CC(=O)N4C3	C₁₈H₂₀N₄O₂	324.4
-	[(2R,3R,4S,5S,6R)-2-(acetyloxymethyl)-5-hexanoyloxy-3-hydroxy-6-[(2S,3R)-2,3,4-trihydroxybutoxy]oxan-4-yl] tetradecanoate - CCCCCCCCCCCCCC(=O)O[C@H]1[C@@H]([C@H](O[C@H]([C@H]1OC(=O)CCCCC)OC[C@@H]([C@@H](CO)O)O)COC(=O)C)O	C₃₂H₅₈O₁₂	634.8
-	Methyl 3-[5-(4-hydroxy-3-methylbut-2-enyl)-1-methylimidazol-4-yl]prop-2-enoate - CC(=CCC1=C(N=CN1C)C=CC(=O)OC)CO	C₁₃H₁₈N₂O₃	250.29
-	2-(3,5-dihydroxy-4,4,10,13-tetramethyl-2,3,6,7,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-5,6-dimethylhept-4-en-3-one - CC(C1CCC2C1(CCC3=C2CCC4(C3(CCC(C4(C)C)O)C)O)C)C(=O)C=C(C)C(C)(C)O	C₃₀H₄₈O₄	472.7
-	NCGC00380921-01_C57H90O29_3-O-[(2S,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-xylopyranosyl-(1->4)-6-deoxy-alpha-L-mannopyranosyl-(1->2)-1-O-[(2beta,3beta,16alpha)-3-(beta-D-glucopyranosyloxy)-2,16,23,24-tetrahydroxy-24,28-dioxoolean-12-en-28-yl]-alpha-L-arabinopyranose - C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2OC(=O)[C@]34CCC(C[C@H]3C5=CCC6[C@]([C@@]5(C[C@H]4O)C)(CCC7[C@@]6(C[C@@H]([C@@H]([C@]7(CO)C(=O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)C)C)(C)C)O)O)O)O)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O[C@H]1[C@@H]([C@](CO1)(CO)O)O)O	C₅₇H₉₀O₂₉	1239.3
-	Khekadaengoside K - CC(=O)[C@H]1[C@@H](C[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C=C(C(=O)C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)C)O	C₃₀H₄₂O₁₀	562.6
-	NCGC00380871-01_C22H27ClO13_(1R,4S,5R,6S,7R,8S)-5-Chloro-9-(beta-D-glucopyranosyloxy)-4-hydroxy-2,10-dioxatricyclo[5.3.1.0~4,8~]undec-6-yl 3,4-dihydroxybenzoate - C1[C@H]2[C@@H]([C@H]([C@@]3([C@H]2C(O[C@H]1OC3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)Cl)OC(=O)C5=CC(=C(C=C5)O)O	C₂₂H₂₇ClO₁₃	534.9
-	Dianchinenoside B, >=95% (LC/MS-ELSD) - C[C@]12CC[C@@H]([C@@](C1CC[C@@]3(C2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)C)C)(C)C(=O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O	C₄₁H₆₄O₁₅	796.9
-	beta-D-glucosyl-(1<->1')-N-tricosanoyl-15-methylhexadecasphinganine - CCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)[C@@H](CCCCCCCCCCCC(C)C)O	C₄₆H₉₁NO₈	786.2