Exact Mass: 527.1692419999999
Exact Mass Matches: 527.1692419999999
Found 415 metabolites which its exact mass value is equals to given mass value 527.1692419999999
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Daunorubicin
C27H29NO10 (527.1791374000001)
Daunorubicin is only found in individuals that have used or taken this drug. It is a very toxic anthracycline aminoglycoside antineoplastic isolated from Streptomyces peucetius and others, used in treatment of leukemia and other neoplasms. [PubChem]Daunorubicin has antimitotic and cytotoxic activity through a number of proposed mechanisms of action: Daunorubicin forms complexes with DNA by intercalation between base pairs, and it inhibits topoisomerase II activity by stabilizing the DNA-topoisomerase II complex, preventing the religation portion of the ligation-religation reaction that topoisomerase II catalyzes. L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01D - Cytotoxic antibiotics and related substances > L01DB - Anthracyclines and related substances C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C259 - Antineoplastic Antibiotic C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C1748 - Topoisomerase Inhibitor C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D004791 - Enzyme Inhibitors KEIO_ID D106
4-O-(beta-L-Araf-(1->2)-beta-L-Araf-(1->2)-beta-L-Araf)-cis-L-Hyp
C20H33NO15 (527.1850108000001)
An O(4)-glycosyl-L-hydroxyproline that is cis-L-hydroxylproline glycosylated by a beta-L-Araf-(1->2)-beta-L-Araf-(1->2)-beta-L-Araf moiety
Gliquidone
Gliquidone is an anti-diabetic drug in the sulfonylurea class. It is used in the treatment of diabetes mellitus type 2. It is an ATP-dependent K+ (KATP) channel blocker. This block causes a depolarization which leads to activation of voltage-dependent Ca channels and Ca2+ influx, and eventually increases insulin release. A - Alimentary tract and metabolism > A10 - Drugs used in diabetes > A10B - Blood glucose lowering drugs, excl. insulins > A10BB - Sulfonylureas C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C97936 - Sulfonylurea Antidiabetic Agent D007004 - Hypoglycemic Agents
Lumefantrine
C30H32Cl3NO (527.1549352000001)
Lumefantrine is an antimalarial agent used to treat acute uncomplicated malaria. It is administered in combination with artemether for improved efficacy. This combination therapy exerts its effects against the erythrocytic stages of Plasmodium spp. and may be used to treat infections caused by P. falciparum and unidentified Plasmodium species, including infections acquired in chloroquine-resistant areas. D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
5-Carboxytetramethylrhodamine succinimidyl ester
C29H25N3O7 (527.1692419999999)
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D012235 - Rhodamines
2-(Dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]fluoren-4-yl]ethanol
C30H32Cl3NO (527.1549352000001)
Esorubicin
C27H29NO10 (527.1791374000001)
D000970 - Antineoplastic Agents
N-Demethylmenogaril
C27H29NO10 (527.1791374000001)
Cerubidin
C27H29NO10 (527.1791374000001)
Pirozadil
C27H29NO10 (527.1791374000001)
(2,6-epoxy-1,2alpha,3beta,4alpha,5alpha-pentahydroxy)hexane-(1->6)-5,6-dihydrochelerythrine|maclekarpine D
C27H29NO10 (527.1791374000001)
His Gln Glu Asp
NK007
Daunorubicin
C27H29NO10 (527.1791374000001)
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01D - Cytotoxic antibiotics and related substances > L01DB - Anthracyclines and related substances C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C259 - Antineoplastic Antibiotic C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C1748 - Topoisomerase Inhibitor C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent A natural product found in Actinomadura roseola. D004791 - Enzyme Inhibitors
Gliquidone
A - Alimentary tract and metabolism > A10 - Drugs used in diabetes > A10B - Blood glucose lowering drugs, excl. insulins > A10BB - Sulfonylureas C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C97936 - Sulfonylurea Antidiabetic Agent D007004 - Hypoglycemic Agents
Ala Asp His Trp
Ala Asp Trp His
Ala His Asp Trp
Ala His Trp Asp
Ala Trp Asp His
Ala Trp His Asp
Cys Cys Phe Arg
Cys Cys Arg Phe
Cys Asp Lys Tyr
C22H33N5O8S (527.2049738000001)
Cys Asp Gln Tyr
C21H29N5O9S (527.1685904000001)
Cys Asp Tyr Lys
C22H33N5O8S (527.2049738000001)
Cys Asp Tyr Gln
C21H29N5O9S (527.1685904000001)
Cys Glu Asn Tyr
C21H29N5O9S (527.1685904000001)
Cys Glu Tyr Asn
C21H29N5O9S (527.1685904000001)
Cys Phe Cys Arg
Cys Phe Met Gln
C22H33N5O6S2 (527.1872158000001)
Cys Phe Gln Met
C22H33N5O6S2 (527.1872158000001)
Cys Phe Arg Cys
Cys Gly Trp Tyr
Cys Gly Tyr Trp
Cys Lys Asp Tyr
C22H33N5O8S (527.2049738000001)
Cys Lys Tyr Asp
C22H33N5O8S (527.2049738000001)
Cys Met Phe Gln
C22H33N5O6S2 (527.1872158000001)
Cys Met Gln Phe
C22H33N5O6S2 (527.1872158000001)
Cys Asn Glu Tyr
C21H29N5O9S (527.1685904000001)
Cys Asn Tyr Glu
C21H29N5O9S (527.1685904000001)
Cys Gln Asp Tyr
C21H29N5O9S (527.1685904000001)
Cys Gln Phe Met
C22H33N5O6S2 (527.1872158000001)
Cys Gln Met Phe
C22H33N5O6S2 (527.1872158000001)
Cys Gln Tyr Asp
C21H29N5O9S (527.1685904000001)
Cys Arg Cys Phe
Cys Arg Phe Cys
Cys Arg Ser Tyr
Cys Arg Tyr Ser
Cys Ser Arg Tyr
Cys Ser Tyr Arg
Cys Trp Gly Tyr
Cys Trp Tyr Gly
Cys Tyr Asp Lys
C22H33N5O8S (527.2049738000001)
Cys Tyr Asp Gln
C21H29N5O9S (527.1685904000001)
Cys Tyr Glu Asn
C21H29N5O9S (527.1685904000001)
Cys Tyr Gly Trp
Cys Tyr Lys Asp
C22H33N5O8S (527.2049738000001)
Cys Tyr Asn Glu
C21H29N5O9S (527.1685904000001)
Cys Tyr Gln Asp
C21H29N5O9S (527.1685904000001)
Cys Tyr Arg Ser
Cys Tyr Ser Arg
Cys Tyr Trp Gly
Asp Ala His Trp
Asp Ala Trp His
Asp Cys Lys Tyr
C22H33N5O8S (527.2049738000001)
Asp Cys Gln Tyr
C21H29N5O9S (527.1685904000001)
Asp Cys Tyr Lys
C22H33N5O8S (527.2049738000001)
Asp Cys Tyr Gln
C21H29N5O9S (527.1685904000001)
Asp Glu His Gln
Asp Glu Gln His
Asp His Ala Trp
Asp His Glu Gln
Asp His Gln Glu
Asp His Trp Ala
Asp Lys Cys Tyr
C22H33N5O8S (527.2049738000001)
Asp Lys Tyr Cys
C22H33N5O8S (527.2049738000001)
Asp Gln Cys Tyr
C21H29N5O9S (527.1685904000001)
Asp Gln Glu His
Asp Gln His Glu
Asp Gln Tyr Cys
C21H29N5O9S (527.1685904000001)
Asp Trp Ala His
Asp Trp His Ala
Asp Tyr Cys Lys
C22H33N5O8S (527.2049738000001)
Asp Tyr Cys Gln
C21H29N5O9S (527.1685904000001)
Asp Tyr Lys Cys
C22H33N5O8S (527.2049738000001)
Asp Tyr Gln Cys
C21H29N5O9S (527.1685904000001)
Glu Cys Asn Tyr
C21H29N5O9S (527.1685904000001)
Glu Cys Tyr Asn
C21H29N5O9S (527.1685904000001)
Glu Asp His Gln
Glu Asp Gln His
Glu Glu His Asn
Glu Glu Asn His
Glu Gly His Trp
Glu Gly Trp His
Glu His Asp Gln
Glu His Glu Asn
Glu His Gly Trp
Glu His Asn Glu
Glu His Gln Asp
Glu His Trp Gly
Glu Asn Cys Tyr
C21H29N5O9S (527.1685904000001)
Glu Asn Glu His
Glu Asn His Glu
Glu Asn Tyr Cys
C21H29N5O9S (527.1685904000001)
Glu Gln Asp His
Glu Gln His Asp
Glu Trp Gly His
Glu Trp His Gly
Glu Tyr Cys Asn
C21H29N5O9S (527.1685904000001)
Glu Tyr Asn Cys
C21H29N5O9S (527.1685904000001)
Phe Cys Cys Arg
Phe Cys Met Gln
C22H33N5O6S2 (527.1872158000001)
Phe Cys Gln Met
C22H33N5O6S2 (527.1872158000001)
Phe Cys Arg Cys
Phe Met Cys Gln
C22H33N5O6S2 (527.1872158000001)
Phe Met Gln Cys
C22H33N5O6S2 (527.1872158000001)
Phe Gln Cys Met
C22H33N5O6S2 (527.1872158000001)
Phe Gln Met Cys
C22H33N5O6S2 (527.1872158000001)
Phe Arg Cys Cys
Gly Cys Trp Tyr
Gly Cys Tyr Trp
Gly Glu His Trp
Gly Glu Trp His
Gly His Glu Trp
Gly His Trp Glu
Gly Trp Cys Tyr
Gly Trp Glu His
Gly Trp His Glu
Gly Trp Tyr Cys
Gly Tyr Cys Trp
Gly Tyr Trp Cys
His Ala Asp Trp
His Ala Trp Asp
His Asp Ala Trp
His Asp Glu Gln
His Asp Gln Glu
His Asp Trp Ala
His Glu Asp Gln
His Glu Glu Asn
His Glu Gly Trp
His Glu Asn Glu
His Glu Gln Asp
His Glu Trp Gly
His Gly Glu Trp
His Gly Trp Glu
His Asn Glu Glu
His Gln Asp Glu
His Trp Ala Asp
His Trp Asp Ala
His Trp Glu Gly
His Trp Gly Glu
Lys Cys Asp Tyr
C22H33N5O8S (527.2049738000001)
Lys Cys Tyr Asp
C22H33N5O8S (527.2049738000001)
Lys Asp Cys Tyr
C22H33N5O8S (527.2049738000001)
Lys Asp Tyr Cys
C22H33N5O8S (527.2049738000001)
Lys Tyr Cys Asp
C22H33N5O8S (527.2049738000001)
Lys Tyr Asp Cys
C22H33N5O8S (527.2049738000001)
Met Cys Phe Gln
C22H33N5O6S2 (527.1872158000001)
Met Cys Gln Phe
C22H33N5O6S2 (527.1872158000001)
Met Phe Cys Gln
C22H33N5O6S2 (527.1872158000001)
Met Phe Gln Cys
C22H33N5O6S2 (527.1872158000001)
Met Asn Thr Tyr
C22H33N5O8S (527.2049738000001)
Met Asn Tyr Thr
C22H33N5O8S (527.2049738000001)
Met Gln Cys Phe
C22H33N5O6S2 (527.1872158000001)
Met Gln Phe Cys
C22H33N5O6S2 (527.1872158000001)
Met Gln Ser Tyr
C22H33N5O8S (527.2049738000001)
Met Gln Tyr Ser
C22H33N5O8S (527.2049738000001)
Met Ser Gln Tyr
C22H33N5O8S (527.2049738000001)
Met Ser Tyr Gln
C22H33N5O8S (527.2049738000001)
Met Thr Asn Tyr
C22H33N5O8S (527.2049738000001)
Met Thr Tyr Asn
C22H33N5O8S (527.2049738000001)
Met Tyr Asn Thr
C22H33N5O8S (527.2049738000001)
Met Tyr Gln Ser
C22H33N5O8S (527.2049738000001)
Met Tyr Ser Gln
C22H33N5O8S (527.2049738000001)
Met Tyr Thr Asn
C22H33N5O8S (527.2049738000001)
Asn Cys Glu Tyr
C21H29N5O9S (527.1685904000001)
Asn Cys Tyr Glu
C21H29N5O9S (527.1685904000001)
Asn Glu Cys Tyr
C21H29N5O9S (527.1685904000001)
Asn Glu Glu His
Asn Glu His Glu
Asn Glu Tyr Cys
C21H29N5O9S (527.1685904000001)
Asn His Glu Glu
Asn Met Thr Tyr
C22H33N5O8S (527.2049738000001)
Asn Met Tyr Thr
C22H33N5O8S (527.2049738000001)
Asn Thr Met Tyr
C22H33N5O8S (527.2049738000001)
Asn Thr Tyr Met
C22H33N5O8S (527.2049738000001)
Asn Tyr Cys Glu
C21H29N5O9S (527.1685904000001)
Asn Tyr Glu Cys
C21H29N5O9S (527.1685904000001)
Asn Tyr Met Thr
C22H33N5O8S (527.2049738000001)
Asn Tyr Thr Met
C22H33N5O8S (527.2049738000001)
Gln Cys Asp Tyr
C21H29N5O9S (527.1685904000001)
Gln Cys Phe Met
C22H33N5O6S2 (527.1872158000001)
Gln Cys Met Phe
C22H33N5O6S2 (527.1872158000001)
Gln Cys Tyr Asp
C21H29N5O9S (527.1685904000001)
Gln Asp Cys Tyr
C21H29N5O9S (527.1685904000001)
Gln Asp Glu His
Gln Asp His Glu
Gln Asp Tyr Cys
C21H29N5O9S (527.1685904000001)
Gln Glu Asp His
Gln Glu His Asp
Gln Phe Cys Met
C22H33N5O6S2 (527.1872158000001)
Gln Phe Met Cys
C22H33N5O6S2 (527.1872158000001)
Gln His Asp Glu
Gln His Glu Asp
Gln Met Cys Phe
C22H33N5O6S2 (527.1872158000001)
Gln Met Phe Cys
C22H33N5O6S2 (527.1872158000001)
Gln Met Ser Tyr
C22H33N5O8S (527.2049738000001)
Gln Met Tyr Ser
C22H33N5O8S (527.2049738000001)
Gln Ser Met Tyr
C22H33N5O8S (527.2049738000001)
Gln Ser Tyr Met
C22H33N5O8S (527.2049738000001)
Gln Tyr Cys Asp
C21H29N5O9S (527.1685904000001)
Gln Tyr Asp Cys
C21H29N5O9S (527.1685904000001)
Gln Tyr Met Ser
C22H33N5O8S (527.2049738000001)
Gln Tyr Ser Met
C22H33N5O8S (527.2049738000001)
Arg Cys Cys Phe
Arg Cys Phe Cys
Arg Cys Ser Tyr
Arg Cys Tyr Ser
Arg Phe Cys Cys
Arg Ser Cys Tyr
Arg Ser Tyr Cys
Arg Tyr Cys Ser
Arg Tyr Ser Cys
Ser Cys Arg Tyr
Ser Cys Tyr Arg
Ser Met Gln Tyr
C22H33N5O8S (527.2049738000001)
Ser Met Tyr Gln
C22H33N5O8S (527.2049738000001)
Ser Gln Met Tyr
C22H33N5O8S (527.2049738000001)
Ser Gln Tyr Met
C22H33N5O8S (527.2049738000001)
Ser Arg Cys Tyr
Ser Arg Tyr Cys
Ser Tyr Cys Arg
Ser Tyr Met Gln
C22H33N5O8S (527.2049738000001)
Ser Tyr Gln Met
C22H33N5O8S (527.2049738000001)
Ser Tyr Arg Cys
Thr Met Asn Tyr
C22H33N5O8S (527.2049738000001)
Thr Met Tyr Asn
C22H33N5O8S (527.2049738000001)
Thr Asn Met Tyr
C22H33N5O8S (527.2049738000001)
Thr Asn Tyr Met
C22H33N5O8S (527.2049738000001)
Thr Tyr Met Asn
C22H33N5O8S (527.2049738000001)
Thr Tyr Asn Met
C22H33N5O8S (527.2049738000001)
Trp Ala Asp His
Trp Ala His Asp
Trp Cys Gly Tyr
Trp Cys Tyr Gly
Trp Asp Ala His
Trp Asp His Ala
Trp Glu Gly His
Trp Glu His Gly
Trp Gly Cys Tyr
Trp Gly Glu His
Trp Gly His Glu
Trp Gly Tyr Cys
Trp His Ala Asp
Trp His Asp Ala
Trp His Glu Gly
Trp His Gly Glu
Trp Tyr Cys Gly
Trp Tyr Gly Cys
Tyr Cys Asp Lys
C22H33N5O8S (527.2049738000001)
Tyr Cys Asp Gln
C21H29N5O9S (527.1685904000001)
Tyr Cys Glu Asn
C21H29N5O9S (527.1685904000001)
Tyr Cys Gly Trp
Tyr Cys Lys Asp
C22H33N5O8S (527.2049738000001)
Tyr Cys Asn Glu
C21H29N5O9S (527.1685904000001)
Tyr Cys Gln Asp
C21H29N5O9S (527.1685904000001)
Tyr Cys Arg Ser
Tyr Cys Ser Arg
Tyr Cys Trp Gly
Tyr Asp Cys Lys
C22H33N5O8S (527.2049738000001)
Tyr Asp Cys Gln
C21H29N5O9S (527.1685904000001)
Tyr Asp Lys Cys
C22H33N5O8S (527.2049738000001)
Tyr Asp Gln Cys
C21H29N5O9S (527.1685904000001)
Tyr Glu Cys Asn
C21H29N5O9S (527.1685904000001)
Tyr Glu Asn Cys
C21H29N5O9S (527.1685904000001)
Tyr Gly Cys Trp
Tyr Gly Trp Cys
Tyr Lys Cys Asp
C22H33N5O8S (527.2049738000001)
Tyr Lys Asp Cys
C22H33N5O8S (527.2049738000001)
Tyr Met Asn Thr
C22H33N5O8S (527.2049738000001)
Tyr Met Gln Ser
C22H33N5O8S (527.2049738000001)
Tyr Met Ser Gln
C22H33N5O8S (527.2049738000001)
Tyr Met Thr Asn
C22H33N5O8S (527.2049738000001)
Tyr Asn Cys Glu
C21H29N5O9S (527.1685904000001)
Tyr Asn Glu Cys
C21H29N5O9S (527.1685904000001)
Tyr Asn Met Thr
C22H33N5O8S (527.2049738000001)
Tyr Asn Thr Met
C22H33N5O8S (527.2049738000001)
Tyr Gln Cys Asp
C21H29N5O9S (527.1685904000001)
Tyr Gln Asp Cys
C21H29N5O9S (527.1685904000001)
Tyr Gln Met Ser
C22H33N5O8S (527.2049738000001)
Tyr Gln Ser Met
C22H33N5O8S (527.2049738000001)
Tyr Arg Cys Ser
Tyr Arg Ser Cys
Tyr Ser Cys Arg
Tyr Ser Met Gln
C22H33N5O8S (527.2049738000001)
Tyr Ser Gln Met
C22H33N5O8S (527.2049738000001)
Tyr Ser Arg Cys
Tyr Thr Met Asn
C22H33N5O8S (527.2049738000001)
Tyr Thr Asn Met
C22H33N5O8S (527.2049738000001)
Tyr Trp Cys Gly
Tyr Trp Gly Cys
Benflumetol
C30H32Cl3NO (527.1549352000001)
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
Pirozadil
C27H29NO10 (527.1791374000001)
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98151 - Niacin-based Antilipidemic Agent
Thymolphthalein phosphoric acid diammonium salt
C28H34NO7P (527.2072784000001)
[3,4,5-triacetyloxy-6-[(2-nitrophenyl)carbamothioylamino]oxan-2-yl]methyl acetate
Benzenepropanoic acid, 4-[[4-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]-2-thiazolyl]methoxy]-2-methyl-
C28H24F3NO4S (527.1378060000001)
Barnidipine
D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators
5(6)-CARBOXYTETRAMETHYLRHODAMINE N-SUCCINIMIDYL ESTER
C29H25N3O7 (527.1692419999999)
Hydro-tris(3-phenylpyrazol-1-yl)borate potassium salt
5(6)-TAMRA, SE [5-(and-6)-Carboxytetramethylrhodamine, succinimidyl ester]
C29H25N3O7 (527.1692419999999)
(R)-2-(3-(3-(4-methoxybenzoyl)-2-methyl-6-(trifluoromethoxy)-1H-indol-1-yl)phenoxy)butanoic acid
N-[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]phenyl]-6,8-dimethyl-2-(2-pyridinyl)-4-quinolinecarboxamide
Lumefantrine
C30H32Cl3NO (527.1549352000001)
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
(1S,3R,4R)-3-ethyl-3,4,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranoside
2-(dibutylamino)-1-{2,7-dichloro-9-[(4-chlorophenyl)methylidene]-9H-fluoren-4-yl}ethan-1-ol
C30H32Cl3NO (527.1549352000001)
(7S,9S)-9-acetyl-7-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
C27H29NO10 (527.1791374000001)
N-[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]phenyl]-6,8-dimethyl-2-(3-pyridinyl)-4-quinolinecarboxamide
[4-({3-[2-(1H-indol-3-yl)ethyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)phenoxy]acetic acid
(7R,9S)-9-acetyl-7-[[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-2-oxanyl]oxy]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
C27H29NO10 (527.1791374000001)
2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
(2R,4S)-4-[[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-2-oxanyl]methyl]-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid
C27H29NO10 (527.1791374000001)
2-[(1R,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-(pyridin-3-ylmethyl)acetamide
2-[(1S,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-(pyridin-3-ylmethyl)acetamide
2-[(1S,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-(pyridin-3-ylmethyl)acetamide
2-[(1R,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide
2-[(1R,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide
2-[(1S,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
2-[(1S,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
2-[(1S,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
2-[(1R,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide
2-[(1S,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide
2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide
2-[(1R,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
2-[(1R,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
2-[(1R,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
2-[(1R,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(pyridin-4-ylmethyl)acetamide
N3-[4-(difluoromethoxy)phenyl]-1-(3,4-dimethylphenyl)-N7-(2-hydroxyethyl)-2-mercaptoimidazo[1,2-a]pyridin-4-ium-3,7-dicarboxamide
C26H25F2N4O4S+ (527.1564493999999)
11-deoxy-beta-rhodomycin zwitterion
A zwitterion obtained by transfer of a proton from the 5-hydroxy to the tertiary amino group of 11-deoxy-beta-rhodomycin; major species at pH 7.3.
9-acetyl-7-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
C27H29NO10 (527.1791374000001)
11-Deoxy-beta-rhodomycin
A member of the class of anthracyclines that is beta-rhodomycin lacking the phenolic hydroxy group at position 11.
4-O-(beta-L-Araf-(1->2)-beta-L-Araf-(1->2)-beta-L-Araf)-cis-L-Hyp zwitterion
C20H33NO15 (527.1850108000001)
An amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of 4-O-(beta-L-Araf-(1->2)-beta-L-Araf-(1->2)-beta-L-Araf)-cis-L-Hyp.
Beperidium iodide
Beperidium iodide shows a competitive antagonistic effect against acetylcholine receptor with a pA2 of 7.93.
(8s,10s)-10-{[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,8,11-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
10-[(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy]-8,11-dihydroxy-8-(2-hydroxyacetyl)-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione
C27H29NO10 (527.1791374000001)
(7s,8s,10r)-10-{[(2s,4r,5r,6r)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,7,8-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
7-{[(2s,4s,5s,6s)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,8,10-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
(1r,2z,6z,10e)-3-formyl-7,11-dimethylcyclododeca-2,6,10-trien-1-yl 6-nitro-2h-phenanthro[3,4-d][1,3]dioxole-5-carboxylate
aristoloterpenate i; 8-demethoxy
{"Ingredient_id": "HBIN016834","Ingredient_name": "aristoloterpenate i; 8-demethoxy","Alias": "NA","Ingredient_formula": "C31H29NO7","Ingredient_Smile": "NA","Ingredient_weight": "527.56","OB_score": "NA","CAS_id": "222403-62-5","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6648","PubChem_id": "NA","DrugBank_id": "NA"}
aristoloterpenate i; 8-demethoxy,2'e-isomer
{"Ingredient_id": "HBIN016835","Ingredient_name": "aristoloterpenate i; 8-demethoxy,2'e-isomer","Alias": "NA","Ingredient_formula": "C31H29NO7","Ingredient_Smile": "NA","Ingredient_weight": "527.56","OB_score": "NA","CAS_id": "222403-63-6","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6647","PubChem_id": "NA","DrugBank_id": "NA"}
aristophyllide a; 5',12'-diepimer,demethoxy
{"Ingredient_id": "HBIN016840","Ingredient_name": "aristophyllide a; 5',12'-diepimer,demethoxy","Alias": "NA","Ingredient_formula": "C31H29NO7","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6644","PubChem_id": "NA","DrugBank_id": "NA"}
aristophyllide a; demethoxy
{"Ingredient_id": "HBIN016841","Ingredient_name": "aristophyllide a; demethoxy","Alias": "NA","Ingredient_formula": "C31H29NO7","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6643","PubChem_id": "NA","DrugBank_id": "NA"}
(10r)-3-hydroxy-23,24-dimethoxy-10-methyl-9,20-dioxa-6-azaheptacyclo[15.12.0.0²,¹⁴.0⁴,¹².0⁶,¹⁰.0¹⁹,²⁸.0²¹,²⁶]nonacosa-1(17),2,4(12),13,15,19(28),21,23,25-nonaene-5,18,27,29-tetrone
(1r,6e,10e)-3-formyl-7,11-dimethylcyclododeca-2,6,10-trien-1-yl 6-nitro-2h-phenanthro[3,4-d][1,3]dioxole-5-carboxylate
(1r,2e,6z,10e)-3-formyl-7,11-dimethylcyclododeca-2,6,10-trien-1-yl 6-nitro-2h-phenanthro[3,4-d][1,3]dioxole-5-carboxylate
(1r,2z,6e,10e)-3-formyl-7,11-dimethylcyclododeca-2,6,10-trien-1-yl 6-nitro-2h-phenanthro[3,4-d][1,3]dioxole-5-carboxylate
10-{[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,7,8,11-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
(7r,10r)-3,22,29-trihydroxy-10-methyl-5,20,27-trioxo-9-oxa-6-azaheptacyclo[15.12.0.0²,¹⁴.0⁴,¹².0⁶,¹⁰.0¹⁹,²⁸.0²¹,²⁶]nonacosa-1(17),2(14),3,12,18,21,23,25,28-nonaene-7-carboxylic acid
(2r)-1-[(5r,6r)-5-ethenyl-5-methyl-6-(3-oxoprop-1-en-2-yl)cyclohex-1-en-1-yl]propan-2-yl 6-nitro-2h-phenanthro[3,4-d][1,3]dioxole-5-carboxylate
(2s,3s,4r,5r)-2-[(s)-[(20s)-17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-yl](hydroxy)methyl]oxane-2,3,4,5-tetrol
C27H29NO10 (527.1791374000001)
(7r,8r)-7-{[(2s,4s,5s,6s)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,8,11-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
10-{[(2r,4s,5s,6s)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,7,8-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
12-(3,4-dimethoxyphenyl)-7-hydroxy-8,16,17-trimethoxy-4-oxa-1-azapentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-2(11),5(10),6,8,12,14(19),15,17,20-nonaen-3-one
(2s)-1-[(5r,6s)-5-ethenyl-5-methyl-6-(3-oxoprop-1-en-2-yl)cyclohex-1-en-1-yl]propan-2-yl 6-nitro-2h-phenanthro[3,4-d][1,3]dioxole-5-carboxylate
3,22,29-trihydroxy-10-methyl-5,20,27-trioxo-9-oxa-6-azaheptacyclo[15.12.0.0²,¹⁴.0⁴,¹².0⁶,¹⁰.0¹⁹,²⁸.0²¹,²⁶]nonacosa-1(17),2(14),3,12,18,21,23,25,28-nonaene-7-carboxylic acid
(7s,8r,10s)-7-{[(2r,4s,5s,6s)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,8,10-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
(8r)-10-{[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,7,8,11-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
(2s)-2-[({2-[(2s)-1-[(2s)-5-carbamimidamido-2-[(1-hydroxyethylidene)amino]pentanoyl]pyrrolidin-2-yl]-1,3-thiazol-4-yl}(hydroxy)methylidene)amino]-4-(methylsulfanyl)butanoic acid
10-{[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,7,8-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
(8s,10s)-8-acetyl-10-{[(2r,4r,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-6,8,11-trihydroxy-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione
C27H29NO10 (527.1791374000001)
(8s,10r)-10-{[(2s,4r,5r,6r)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8,11-dihydroxy-8-(2-hydroxyacetyl)-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione
C27H29NO10 (527.1791374000001)
18-ethyl-9,10,20-trihydroxy-8-methoxy-7,20,23-trimethyl-4,6,19-trioxa-22-azahexacyclo[12.11.0.0³,¹¹.0⁵,¹⁰.0¹⁶,²⁵.0¹⁷,²²]pentacosa-1(25),3(11),13,16,23-pentaene-2,12,15-trione
C27H29NO10 (527.1791374000001)
(8s,10s)-10-{[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8,11-dihydroxy-8-(2-hydroxyacetyl)-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione
C27H29NO10 (527.1791374000001)
3-hydroxy-23,24-dimethoxy-10-methyl-9,20-dioxa-6-azaheptacyclo[15.12.0.0²,¹⁴.0⁴,¹².0⁶,¹⁰.0¹⁹,²⁸.0²¹,²⁶]nonacosa-1(17),2,4(12),13,15,19(28),21,23,25-nonaene-5,18,27,29-tetrone
7-{[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-1,6,8,10-tetrahydroxy-9,10-dihydro-7h-tetracene-5,12-dione
(5s,7r,8s,9r,10r,18r,20r)-18-ethyl-9,10,20-trihydroxy-8-methoxy-7,20,23-trimethyl-4,6,19-trioxa-22-azahexacyclo[12.11.0.0³,¹¹.0⁵,¹⁰.0¹⁶,²⁵.0¹⁷,²²]pentacosa-1(25),3(11),13,16,23-pentaene-2,12,15-trione
C27H29NO10 (527.1791374000001)
(2s)-1-[(5r,6r)-5-ethenyl-5-methyl-6-(3-oxoprop-1-en-2-yl)cyclohex-1-en-1-yl]propan-2-yl 6-nitro-2h-phenanthro[3,4-d][1,3]dioxole-5-carboxylate
(1s,8s,10s,11r,12s,13s)-3-hydroxy-4,11,12-trimethoxy-17-methyl-18-oxa-17-azapentacyclo[8.4.3.1⁸,¹¹.0¹,¹⁰.0²,⁷]octadeca-2,4,6-trien-13-yl 4-hydroxy-3-methoxybenzoate
2-({17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-yl}(hydroxy)methyl)oxane-2,3,4,5-tetrol
C27H29NO10 (527.1791374000001)