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: O=C(OC1C(=C)C2CCC13C4OC5N6CCOC6C7(C)CCCC5(C7C4)C3C2)C

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)

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)-

CAS: 114531-28-1

• Formula: C₂₄H₃₃NO₄
• Purity: 98.5%
• Color and Shape: Solid
• Molecular weight: 399.5231

Spiramine A

CAS: 114531-28-1

• Formula: C₂₄H₃₃NO₄
• Purity: 95%~99%
• Color and Shape: Powder
• Molecular weight: 399.531

Spiramine A

CAS: 114531-28-1

Spiramine A is a diterpene that has been isolated from the genus Spiraea. This molecule …

• Formula: C₂₄H₃₃NO₄
• Purity: Min. 95%
• Molecular weight: 399.5 g/mol