Taspine

CAT: 1596-AR-T01183-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T01183-02Size:25 Units

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CAS Number

602-07-3

Synonyms

1- (2- (dimethylamino) ethyl) -3,8-dimethoxychromeno[5,4,3-cde]chromene-5,10-dione; {1- (2-dimethylaminoethyl) -3,8-dimethoxychromeno[5,4,3-cde]chromene-5,10-dione}

Molecular Formula

C20H19NO6

Molecular Weight

369.38

API Name

Taspine

Chemical Information

Taspine

taspine has been reported in Caulophyllum thalictroides, Gymnospermium darwasicum, and other organisms with data available.

CAS Number	602-07-3
PubChem CID	215159
IUPAC Name	5-[2-(dimethylamino)ethyl]-7,14-dimethoxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4(16),5,7,11(15),12-hexaene-3,10-dione
Molecular Formula	C20H19NO6
Molecular Weight	369.4
XLogP	2.8
Topological Polar Surface Area	74.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Heavy Atom Count	27
Formal Charge	0
Complexity	595

SMILES

CN(C)CCC1=CC(=C2C3=C1C(=O)OC4=C(C=CC(=C34)C(=O)O2)OC)OC

InChI

InChI=1S/C20H19NO6/c1-21(2)8-7-10-9-13(25-4)18-16-14(10)20(23)27-17-12(24-3)6-5-11(15(16)17)19(22)26-18/h5-6,9H,7-8H2,1-4H3

InChIKey

MTAWKURMWOXCEO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 602-07-3

CID: 215159

Formula: C20H19NO6

MW: 369.4

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	369.4
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	369.12123733
Monoisotopic Mass	369.12123733
Topological Polar Surface Area	74.3 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	595
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
TRC-T007800-50MG	Taspine

Taspine

Chemical Information

Alternative Products

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