CAS 114531-28-1

12aH,14H-3,14a-Ethano-14,4b,8-ethanylylidene-1H,5H-[2]benzopyrano[4,3-g]oxazolo[3,2-a]azocin-1-ol, decahydro-8-methyl-2-methylene-, acetate (ester), (1S,3S,4aR,4bR,8R,8aS,12aS,14R,14aR,18R)-

Description:

The chemical substance with the name "12aH,14H-3,14a-Ethano-14,4b,8-ethanylylidene-1H,5H-[2]benzopyrano[4,3-g]oxazolo[3,2-a]azocin-1-ol, decahydro-8-methyl-2-methylene-, acetate (ester), (1S,3S,4aR,4bR,8R,8aS,12aS,14R,14aR,18R)" and CAS number "114531-28-1" is a complex organic compound characterized by its intricate polycyclic structure, which includes multiple fused rings and functional groups. This compound features an acetate ester group, indicating it has an acyl functional group derived from acetic acid. The stereochemistry is specified by the presence of multiple chiral centers, denoted by the (1S,3S,4aR,4bR,8R,8aS,12aS,14R,14aR,18R) configuration, which suggests that the compound exhibits specific spatial arrangements that can influence its biological activity and interactions. The presence of a benzopyrano structure indicates potential applications in medicinal chemistry, particularly in the development of pharmaceuticals. Overall, this compound's unique structural features and stereochemistry may contribute to its potential utility in various chemical and biological applications.

Formula: C₂₄H₃₃NO₄

InChI: InChI=1S/C24H33NO4/c1-13-15-5-8-24(19(13)28-14(2)26)17(11-15)23-7-4-6-22(3)16(23)12-18(24)29-21(23)25-9-10-27-20(22)25/h15-21H,1,4-12H2,2-3H3/t15?,16-,17+,18-,19+,20+,21+,22-,23+,24-/m1/s1

InChI key: InChIKey=ZPELMDXCJZDIBP-NCANIYPBSA-N

SMILES: C[C@@]12[C@@]3([C@]4([C@]5([C@]6([C@@](C3)(O[C@@]4(N7[C@]1(OCC7)[H])[H])[H])[C@@H](OC(C)=O)C(=C)C(C5)(CC6)[H])[H])CCC2)[H]

Synonyms:

• (15α,19S)-23-Deoxy-19,23-epoxyajaconine acetate (ester)
• 12aH,14H-3,14a-Ethano-14,4b,8-ethanylylidene-1H,5H-[2]benzopyrano[4,3-g]oxazolo[3,2-a]azocin-1-ol, decahydro-8-methyl-2-methylene-, acetate (ester), (1S,3S,4aR,4bR,8R,8aS,12aS,14R,14aR,18R)-
• 12aH,14H-3,14a-Ethano-14,4b,8-ethanylylidene-1H,5H-[2]benzopyrano[4,3-g]oxazolo[3,2-a]azocin-1-ol, decahydro-8-methyl-2-methylene-, acetate (ester), [1S-(1α,3α,4aβ,4bβ,8β,8aα,12aβ,14β,14aα,18S*)]-
• Isoatisine, 7,20-epoxy-, acetate (ester), (7α,15α,19S,20R)-
• Spiramine A
• Spiramine C acetate (ester)

(15α,19S)-23-Deoxy-19,23-epoxyajaconine acetate

CAS: 114531-28-1

Formula: C₂₄H₃₃NO₄

Purity: 98.5%

Color and Shape: Solid

Molecular weight: 399.5231

Ref: IN-DA000ENX

Spiramine A

CAS: 114531-28-1

Spiramine A is a natural product of Spiraea, Rosaceae.

Formula: C₂₄H₃₃NO₄

Color and Shape: Solid

Molecular weight: 399.531

Ref: TM-TN6005

Spiramine A

CAS: 114531-28-1

Formula: C₂₄H₃₃NO₄

Purity: 95%~99%

Color and Shape: Powder

Molecular weight: 399.531

Ref: BP-SBP00389

Spiramine A (contains ~15% Spiramine B)

CAS: 114531-28-1

Spiramine A is a bioactive compound, specifically classified as an alkaloid. It is derived from the natural source Alstonia scholaris, a medicinal plant known for its diverse therapeutic properties. The mode of action of Spiramine A primarily involves its interaction with specific cellular receptors, modulating biochemical pathways to exhibit potential therapeutic effects.

Formula: C₂₄H₃₃NO₄

Purity: Min. 98.0 Area-%

Molecular weight: 399.5 g/mol

Ref: 3D-PEA53128