Cas no 478-61-5 (Berbamine)

Berbamine structure
Berbamine structure
Product Name:Berbamine
CAS No:478-61-5
MF:C37H40N2O6
MW:608.7233
MDL:MFCD00067632
CID:37647
PubChem ID:12300053
Update Time:2024-10-29

Berbamine Chemical and Physical Properties

Names and Identifiers

    • berbamine
    • Berbamine Dihydrochloride
    • Berbamine Hydrochloride
    • 6,6',7-trimethoxy-2,2'-dimethylberbaman-12-ol
    • 6,7,6'-trimethoxy-2,2'-dimethyl-berbaman-12-ol
    • BERBAINE
    • BERBAMAN-12-OL,6,6',7-TRIMETHOXY-2,2'-DIMETHYL
    • berberamine
    • E6 berbamine
    • [ "" ]
    • Berbenine
    • d-Berbamine
    • C37H40N2O6
    • STK801360
    • BBL009958
    • NCI60_000125
    • BC202968
    • W1165
    • (+)-Berbamine
    • V5KM4XJ0WM
    • TNP00325
    • s9141
    • BDBM50241654
    • NCI60_003398
    • AK167975
    • 6078-1
    • CHEMBL1198334
    • NSC-105131
    • SCHEMBL19041
    • 20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol
    • CHEBI:182116
    • MFCD00067632
    • d-Berbamine pound>>6,6',7-trimethoxy-2,2'-dimethyl-berbaman-12-ol
    • AC-1313
    • AC-20191
    • FT-0622872
    • GNF-Pf-1034
    • Q-100513
    • MMV007474
    • NSC766769
    • AKOS005612992
    • BCP29709
    • NSC-766769
    • 478-61-5
    • 16h-1,24:6,9-dietheno-11,15-metheno-2H-pyrido(2',3':17,18)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinolin-12-ol, 3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, (4aS,16aR)-
    • NS00043460
    • SCHEMBL19039
    • SR-05000002322-2
    • NSC-121842
    • NCGC00017375-01
    • NCGC00142548-01
    • BRN 0078902
    • AKOS015896768
    • 2-27-00-00891 (Beilstein Handbook Reference)
    • 16h-1,24:6,9-dietheno-11,15-metheno-2H-pyrido(2',3':17,18)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinolin-12-ol, 3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, (4aS-(4aR*,16aS*))-
    • WLN: T-T66 CNT&J C1 HO1 IO- JT66 CNT&J C1 HO1 IO1 B1R DQ COR D1- B-18-J
    • BERBAMINE [MI]
    • NSC-369310
    • NCGC00017375-03
    • CS-0009732
    • Q4891024
    • CHEMBL504323
    • UNII-V5KM4XJ0WM
    • SR-05000002322
    • DTXSID40963943
    • HY-N0714
    • Berbaman-12-ol, 6,6',7-trimethoxy-2,2'-dimethyl-
    • BERBAMINE [WHO-DD]
    • NCGC00017375-02
    • TERT-BUTYL1,3-BENZODIOXOL-4-YLCARBAMATE
    • C09357
    • CCG-270219
    • NSC 121842
    • MS-30684
    • EINECS 207-523-5
    • Berbaman-12-ol,6',7-trimethoxy-2,2'-dimethyl-
    • CHEBI:3063
    • CCRIS 6538
    • BERBAMINE, (+)-
    • (1R,14S)-20,21,25-Trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol
    • NSC121842
    • (1S,14R)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol
    • berbamine, (1'beta)-isomer
    • GLXC-13289
    • Berbaman-12-ol, 6,6',7-Trimethoxy-2,2'-dimethyl-(9CI)
    • 6078-17-7
    • berbamine, (+)
    • (1S,14R)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo(22.6.2.23,6.18,12.114,18.027,31.022,33)hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol
    • berbamine, (1beta)-isomer
    • DTXCID301391667
    • DFOCUWZXJBAUSQ-URLMMPGGSA-N
    • Berbamine
    • MDL: MFCD00067632
    • Inchi: 1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-31-18-23(8-11-30(31)40)17-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29+/m0/s1
    • InChI Key: DFOCUWZXJBAUSQ-URLMMPGGSA-N
    • SMILES: O1C2=C(C([H])=C3C([H])([H])C([H])([H])N(C([H])([H])[H])[C@@]([H])(C([H])([H])C4C([H])=C([H])C(=C([H])C=4[H])OC4=C(C([H])=C([H])C(=C4[H])C([H])([H])[C@]4([H])C5=C1C(=C(C([H])=C5C([H])([H])C([H])([H])N4C([H])([H])[H])OC([H])([H])[H])OC([H])([H])[H])O[H])C3=C2[H])OC([H])([H])[H]
    • BRN: 0078902

Computed Properties

  • Exact Mass: 608.28900
  • Monoisotopic Mass: 608.28863700 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 45
  • Rotatable Bond Count: 3
  • Complexity: 963
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 72.9
  • Molecular Weight: 608.7
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 6.1

Experimental Properties

  • Color/Form: Powder
  • Density: 1.1648 (rough estimate)
  • Melting Point: 198.5°C
  • Boiling Point: 655.15°C (rough estimate)
  • Flash Point: 381.4 oC
  • Refractive Index: 1.5300 (estimate)
  • PSA: 72.86000
  • LogP: 6.73520
  • Solubility: Not determined
  • pka: pKa (20°): 7.33 in aq methanol
  • Specific Rotation: D20 +114.6° (c = 1.0 in chloroform)

Berbamine Security Information

  • Safety Instruction: S26; S36
  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38

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Berbamine Suppliers

Amadis Chemical Company Limited
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(CAS:478-61-5)Berbamine
Order Number:A1203370
Stock Status:in Stock
Quantity:50mg/100mg
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 02:50
Price ($):227.0/342.0
Hubei Cuiyuan Biotechnology Co.,Ltd
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(CAS:478-61-5)Berbamine
Order Number:CRN0720
Stock Status:in stock
Quantity:5mg/20mg/50mg
Purity:≥98%
Pricing Information Last Updated:Friday, 14 March 2025 10:55
Price ($):
Suzhou Senfeida Chemical Co., Ltd
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(CAS:478-61-5)BERBAMINE
Order Number:1633565
Stock Status:in Stock
Quantity:Company Customization
Purity:98%
Pricing Information Last Updated:Monday, 14 April 2025 21:49
Price ($):discuss personally
Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:478-61-5)小檗胺
Order Number:LE1633565
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:29
Price ($):discuss personally

Berbamine Related Literature

Recommended suppliers
Amadis Chemical Company Limited
(CAS:478-61-5)Berbamine
A1203370
Purity:99%/99%
Quantity:50mg/100mg
Price ($):227.0/342.0
Email
Hubei Cuiyuan Biotechnology Co.,Ltd
(CAS:478-61-5)Berbamine
CRN0720
Purity:≥98%
Quantity:5mg/20mg/50mg
Price ($):Inquiry
Email