1. chem960
  2. 518-17-2
Introduction

Evodiamine(EVODIAMINE)It is a chemical substance extracted from tetraphyllum plants,Was shown to reduce fat intake in mouse experiments.It is presumed that its mechanism of action is similar to that of capsaicin.therefore,It has been included in some dietary supplements,Mainly as a thermogenic agent and stimulant,Also by increasing the amount ofserotoninNumber of transporters,promoteserotoninReuptake of,Plays a similar role to that of tianneputin.

Names and Identifiers
  • EVODIAMINE
  • Evodiamine std.
  • 8,13,13b,14-Tetrahydro-14-methylindolo[2'3'-3,4]pyrido[2,1-b]quinazolin-5-[7H]-one
  • 8,13,13b,14-tetrahydro-14-methyl-,(S)-
  • Indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one
  • Indol(2',3':3,4)pyrido(2,1-b)quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (S)-
  • Indolo(2',3':3,4)pyrido(2,1-b)quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-
  • Evodia rutaecarpa E.P.
  • [13bS,(+)]-8,13,13b,14-Tetrahydro-14-methylindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one
  • [13bS,(+)]-8,13,13b,14-Tetrahydro-14-methylindolo[2',3':3,4]pyrido[2,1-b]quinazoline-5(7H)-one
  • d-Evodiamine
  • (+)-Evodiamine
  • EVODIAMINE(P) PrintBack
  • Indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (13bS)-
  • EVODIAMINE PLANT EXTRACT
  • [ "(+)-Evodiamine" ]
  • Evodiamine
  • SMR001934404
  • (S)-14-methyl-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(13H)-one
  • Evodiamine, European Pharmacopoeia (EP) Reference Standard
  • INDOLO(2',3':3,4)PYRIDO(2,1-B)QUINAZOLIN-5(7H)-ONE, 8,13,13B,14-TETRAHYDRO-14-METHYL-, (13BS)-
  • BCP02282
  • CS-6161
  • C19H17N3O
  • VS-12304
  • C09187
  • CHEMBL463165
  • (1S)-21-METHYL-3,13,21-TRIAZAPENTACYCLO[11.8.0.0(2),(1)?.0?,?.0(1)?,(2)?]HENICOSA-2(10),4,6,8,15,17,19-HEPTAEN-14-ONE
  • C01825BVNL
  • BDBM50560847
  • (1S)-21-methyl-3,13,21-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,15,17,19-heptaen-14-one
  • AKOS005622478
  • MLS006011787
  • SCHEMBL682158
  • CHEBI:4948
  • Q27894193
  • HY-N0114
  • (S)-14-methyl-8,13,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one
  • EVODIAMINE [WHO-DD]
  • Indol(2',3':3,4)pyrido(2,1-b)quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (13bS)-
  • DTXSID10966123
  • Evodiamine,(S)
  • EVODIAMINE [MI]
  • Q-100579
  • Evodiamine, (+)-
  • UNII-C01825BVNL
  • 518-17-2
  • MDL:MFCD06407824
  • InChIKey:TXDUTHBFYKGSAH-SFHVURJKSA-N
  • Inchi:InChI=1S/C19H17N3O/c1-21-16-9-5-3-7-14(16)19(23)22-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-9,18,20H,10-11H2,1H3/t18-/m0/s1
  • SMILES:O=C1C2=CC=CC=C2N(C)[C@](N1CC3)([H])C4=C3C5=CC=CC=C5N4
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 303.4g/mol
  • Surface Charge: 0
  • XLogP3: 3.1
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Rotatable Bond Count: 0
  • Monoisotopic Mass: 303.137162g/mol
  • Monoisotopic Mass: 303.137162g/mol
  • Topological Polar Surface Area: 39.3Ų
  • Heavy Atom Count: 23
  • Complexity: 495
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 1
  • Topological Polar Surface Area: 39.3
  • Formal charge: 0
  • Functional 3D Acceptor Count: 1
  • Rotatable Bond Count: 0.6
  • isomeric RMSD: 0.6
  • CID conformational isomer Count: 4
  • Functional 3D Donor Count: 1
  • Functional 3D ring Count: 5
  • Functional 3D Cation Count: 2
  • Surface Charge: 0

Experimental Properties

  • LogP: 3.31770
  • PSA: 39.34000
  • Refractive Index: 1.5900 (estimate)
  • Boiling Point: 444.29°C (rough estimate)
  • Melting Point: 278°
  • Flash Point: 575.1 °C at 760 mmHg
  • Solubility: Soluble in DMSO (5 mg/mL,warm to 40°C), water (<1 mg/mL) at 25 °C, and ethanol (<1 mg/mL) at 25 °C
  • Color/Form: Powder
  • Solubility: Soluble in acetone, slightly soluble in ethanol, ether, chloroform, almost insoluble in water, petroleum ether, benzene
  • Sensitiveness: Sensitive to light
  • Specific Rotation: D15 +352° (acetone); D +440° (chloroform)
  • Density: 1.1684 (rough estimate)
Security Information
  • Symbol: GHS06
  • WGK Germany:3
  • Safety Term:S45
  • Safety Instruction:S45
  • Risk Phrases:R25
  • Tehlikeli mal işareti: T T
  • Hazardous Material transportation number:UN 2811 6.1/PG 3
  • Hazard Statement:H300
  • Warning Statement:P264,P301+P310
  • Storage Condition:Powder -20°C 3 years   4°C 2 years In solvent -80°C 6 months   -20°C 1 month
  • PackingGroup:II
  • Hazard Category Code:25
  • Signal Word:Danger
  • HazardClass:6.1
Customs Data
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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