Aranorosin

CAT: 0498-bs-75095C-02Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0498-bs-75095C-02Size:1 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

117184-53-9

Conjugation

Unconjugated

Purity

>95% (HPLC)

Buffer

Solid

Solubility

Soluble in DMSO, ethanol or methanol.

Smiles

CCCCCC[C@H](C)\C=C(/C)\C=C\C(=O)N[C@@H]1C[C@]2(O[C@@H]1O)[C@H]1O[C@H]1C(=O)[C@H]1O[C@@H]21

Molecular Formula

C23H33NO6

Molecular Weight

419.5

Storage Conditions

Stable for 3 years after receipt when stored at -20°C.

Appearance

White solid.

Chemical Information

Aranorosin

Aranorosin is an oxacycle.

CAS Number	117184-53-9
PubChem CID	10002165
IUPAC Name	(2E,4E,6R)-N-[(1S,2'R,3R,3'S,5S,7R)-2'-hydroxy-6-oxospiro[4,8-dioxatricyclo[5.1.0.03,5]octane-2,5'-oxolane]-3'-yl]-4,6-dimethyldodeca-2,4-dienamide
Molecular Formula	C23H33NO6
Molecular Weight	419.5
XLogP	3.6
Topological Polar Surface Area	101
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	9
Heavy Atom Count	30
Formal Charge	0
Complexity	726

SMILES

CCCCCC[C@@H](C)/C=C(\C)/C=C/C(=O)N[C@H]1CC2([C@@H]3[C@@H](O3)C(=O)[C@@H]4[C@H]2O4)O[C@H]1O

InChI

InChI=1S/C23H33NO6/c1-4-5-6-7-8-13(2)11-14(3)9-10-16(25)24-15-12-23(30-22(15)27)20-18(28-20)17(26)19-21(23)29-19/h9-11,13,15,18-22,27H,4-8,12H2,1-3H3,(H,24,25)/b10-9+,14-11+/t13-,15+,18-,19+,20-,21+,22-,23?/m1/s1

InChIKey

JHTWWPWUODMKEO-BPILEAOSSA-N

Chemical Structure

2D Structure

CAS: 117184-53-9

CID: 10002165

Formula: C23H33NO6

MW: 419.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	419.5
XLogP3	3.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	9
Exact Mass	419.23078777
Monoisotopic Mass	419.23078777
Topological Polar Surface Area	101 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	726
Isotope Atom Count	0
Defined Atom Stereocenter Count	7
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
573262	Aranorosin

Aranorosin

Chemical Information

Alternative Products

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