Basic information
- CAS
53948-07-5- Standard SMILES
COc1c(O)cc2c3c(cc4ccccc4c13)NC2=O- InChIKey
ZEKAIRFOYPDZNC-UHFFFAOYSA-N- Molecular formula
- C16H11NO3
- Average molar mass
- 265.26 g/mol
- Monoisotopic mass
- 265.07389321
Overview
Aristolactam AII is an alkaloid.
Names & identifiers
- Preferred name
- Aristolactam Aii
- IUPAC
- 14-hydroxy-15-methoxy-10-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,4,6,8,12,14-heptaen-11-one
- English name
- ARISTOLACTAM-AII
- Molecular formula
- C16H11NO3
- Molecular weight
- 265.26
Names & synonyms
Aristolactam AII14-hydroxy-15-methoxy-10-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,4,6,8,12,14-heptaen-11-one14-hydroxy-15-methoxy-10-azatetracyclo(7.6.1.02,7.012,16)hexadeca-1(16),2,4,6,8,12,14-heptaen-11-oneRefChem:107719353948-07-5Aristolactam A IIAristolactam-aiiaristololactam AII2-Hydroxy-1-methoxydibenzo[cd,f]indol-4(5H)-oneDibenz(cd,f)indol-4(5H)-one, 2-hydroxy-1-methoxy-Dibenz[cd,f]indol-4(5H)-one, 2-hydroxy-1-methoxy-Aristololactam A II; NSC 615450
Show more names
Aristololactam A-IIAristololactam A IIAristolochic acid AII6-Demethoxytoussalactam2-O-Demethylaristolactam BIIAristolochic Acid Impurity 22-Hydroxy-1-methoxydibenz[cd,f]indol-4(5H)-one3-Hydroxy-4-methoxy-10-aminophenanthrene-1-carboxylic acid 1,10-lactam
Aristololactam AAristolactamAIICCRIS 2996NSC615450CHEMBL390368orb1683131SCHEMBL29380851DTXSID50202234
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 413
Physicochemical properties
- Melting point
- 270 · 270-272 °C
- Boiling point
- 459.2 · 459.2±38.0 °C(Predicted)
- Density
- 1.441 · 1.441±0.06 g/cm3(Predicted)
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- form
- powder
- pka
- 8.59 · 8.59±0.20(Predicted)
- color
- Yellow
- InChI
- InChI=1S/C16H11NO3/c1-20-15-12(18)7-10-13-11(17-16(10)19)6-8-4-2-3-5-9(8)14(13)15/h2-7,18H,1H3,(H,17,19)
- InChIKey
- ZEKAIRFOYPDZNC-UHFFFAOYSA-N
- SMILES
- N1C2=C3C(C(OC)=C(O)C=C3C1=O)=C1C=CC=CC1=C2
Chemistry & industry
Applications
UsesAristolactam A II is a Aristolactam. Aristolactam a small group of compounds mainly found in the Aristolochiaceae[1].
Suppliers37 total
成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
成都埃法生物科技有限公司028-028-85142057 19983342022 · [email protected]
成都市久鼎化学技术有限公司18584079237 · [email protected]
Shaanxi Haibo Biotechnology Co., Ltd+86-18629295024 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
天津万象恒远科技有限公司15722085254 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…