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
23199-14-6	(1R,4R)-Methyl 4-(aminomethyl)cyclohexanecarboxylate 4-(氨甲基)环己甲酸甲酯 COC(=O)C1CCC(CC1)CN	C₉H₁₇NO₂	171.24
1264-62-6	Erythromycin Ethylsuccinate 琥乙红霉素 CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)OC(=O)CCC(=O)OCC)(C)O)C)C)O)(C)O	C₄₃H₇₅NO₁₆	862.1
7704-67-8	Erythromycin Thiocyanate 硫氰酸红霉素 CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O.C(#N)S	C₃₈H₆₈N₂O₁₃S	793.0
17086-28-1	Doxycycline monohydrate 强力霉素一水物 CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O	C₂₂H₂₆N₂O₉	462.4
110588-57-3	Saperconazole 沙康唑 CCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OCC5COC(O5)(CN6C=NC=N6)C7=C(C=C(C=C7)F)F	C₃₅H₃₈F₂N₈O₄	672.7
121470-24-4	Azithromycin Monohydrate 一水阿奇霉素 CCC1C(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)C)O)(C)O.O	C₃₈H₇₄N₂O₁₃	767.0
16506-27-7	Bendamustine 宾达氮芥 CN1C2=C(C=C(C=C2)N(CCCl)CCCl)N=C1CCCC(=O)O	C₁₆H₂₁Cl₂N₃O₂	358.3
81129-83-1	Cilastatin sodium 西司他丁钠 CC1(CC1C(=O)NC(=CCCCCSCC(C(=O)O)N)C(=O)[O-])C.[Na+]	C₁₆H₂₅N₂NAO₅S	380.4
13171-00-1	Celestolide 4-乙酰基-6-叔丁基-1,1-二甲基茚满 CC(=O)C1=C2CCC(C2=CC(=C1)C(C)(C)C)(C)C	C₁₇H₂₄O	244.37
2438-32-6	Dexchlorpheniramine Maleate 马来酸右氯苯那敏 CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=CC(=O)O)C(=O)O	C₂₀H₂₃ClN₂O₄	390.9