Structure

Deltaline

CAS
6836-11-9
Catalog Number
ACM6836119
Category
Other Products
Molecular Weight
507.6
Molecular Formula
C27H41NO8

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Specification

Synonyms
Deltamine 6-acetate
InChI
InChI=1S/C27H41NO8/c1-7-28-12-23(3)9-8-17(32-5)26-20(23)21(36-14(2)29)27(22(26)28)25(34-13-35-27)11-16(31-4)15-10-24(26,30)19(25)18(15)33-6/h15-22,30H,7-13H2,1-6H3/t15-,16+,17+,18+,19+,20-,21+,22?,23+,24+,25-,26-,27-/m1/s1
InChI Key
DTTPWCNKTMQMTE-DZZCPBQSSA-N
Melting Point
182-184 °C
Complexity
979
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
12
Exact Mass
507.28321727
Heavy Atom Count
36
Hydrogen Bond Acceptor Count
9
Hydrogen Bond Donor Count
1
Isomeric SMILES
CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@@H]([C@@]5(C31)[C@]6(C[C@@H]([C@H]7C[C@@]4([C@@H]6[C@H]7OC)O)OC)OCO5)OC(=O)C)OC)C
Monoisotopic Mass
507.28321727
Physical State
Powder
Rotatable Bond Count
6
Topological Polar Surface Area
95.9 Ų
What is the product name of the compound?

The product name is DELTALINE.

What are some synonyms for DELTALINE?

Some synonyms for DELTALINE are DELTALINE and ELDELINE.

What is the molecular formula of DELTALINE?

The molecular formula of DELTALINE is C27H41NO8.

What is the molecular weight of DELTALINE?

The molecular weight of DELTALINE is 507.62.

What is the storage temperature recommended for DELTALINE?

The storage temperature recommended for DELTALINE is 2-8°C.

In what form is DELTALINE found?

DELTALINE is found in solid form.

What safety statements are associated with DELTALINE?

The safety statements associated with DELTALINE are 22-36/37/39-45.

What is the WGK Germany classification for DELTALINE?

DELTALINE is classified as WGK Germany 3.

How is the structure of DELTALINE described in the reference?

The structure of DELTALINE is described as an aconine alkaloid.

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