Products for Research Use Only
RegisterLogin

Berbamine hydrochloride 200mg

CAT: 0628-A14816-200Size: 200 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A14816-200Size:200 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
6078-17-7

Chemical Information

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-, hydrochloride (1:2), (4aS,16aR)-

See also: (+)-Berbamine (annotation moved to).

CAS Number6078-17-7
PubChem CID16217067
IUPAC Name(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;dihydrochloride
Molecular FormulaC37H42Cl2N2O6
Molecular Weight681.6
Topological Polar Surface Area72.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count47
Formal Charge0
Complexity963
SMILES
CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@@H]6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)O)OC.Cl.Cl
InChI
InChI=1S/C37H40N2O6.2ClH/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;2*1H/t28-,29+;;/m0../s1
InChIKey
USRXDYNDPPUBSG-KKXMJGKMSA-N
Chemical Structure
2D Structure
2D structure of 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-, hydrochloride (1:2), (4aS,16aR)-
CAS: 6078-17-7
CID: 16217067
Formula: C37H42Cl2N2O6
MW: 681.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight681.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass680.2419925
Monoisotopic Mass680.2419925
Topological Polar Surface Area72.9 Ų
Heavy Atom Count47
Formal Charge0
Complexity963
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

Related Products

CatalogName
A14816-500Berbamine hydrochloride 500mg
A14816-1000Berbamine hydrochloride 1000mg
A14816-10mM-DBerbamine hydrochloride 10mM * 1mL in DMSO
A16156-200Cefmenoxime hydrochloride 200mg
A20009-200VU591 hydrochloride 200mg
A16670-200Pioglitazone hydrochloride 200mg
A10147-200Biperiden hydrochloride 200mg
A13409-200Idazoxan Hydrochloride 200mg
A15271-200Vandetanib hydrochloride 200mg
A15174-200MTEP hydrochloride 200mg

Alternative Products

CatalogName
AB0929Hydrochloride Berbamine
299997Berbamine Hydrochloride
MBS5750320Berbamine

Popular Products