Tanshinone IIA

CAT: 0024-sc-200932Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-200932Size:5 mg

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CAS Number

568-72-9

Chemical Information

Tanshinone Iia

1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g]benzofuran-10,11-dione is an abietane diterpenoid.

CAS Number	568-72-9
PubChem CID	164676
IUPAC Name	1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione
Molecular Formula	C19H18O3
Molecular Weight	294.3
XLogP	4.3
Topological Polar Surface Area	47.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	22
Formal Charge	0
Complexity	509

SMILES

CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C

InChI

InChI=1S/C19H18O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,9H,4-5,8H2,1-3H3

InChIKey

HYXITZLLTYIPOF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 568-72-9

CID: 164676

Formula: C19H18O3

MW: 294.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	294.3
XLogP3	4.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	294.125594432
Monoisotopic Mass	294.125594432
Topological Polar Surface Area	47.3 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	509
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

Catalog	Name
E1KS2365	Tanshinone IIA (Tanshinone B)
A10890-5	Tanshinone IIA (Tanshinone B) 5mg
TBZ0939	Tanshinone VI
TN2257	Tanshinone IIB
T2906	Tanshinone IIA
AB0581	Tanshinone I