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 Registry Number®
114531-28-1
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CAS 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)-Molecular Formula
C24H33NO4Molecular Mass
399.52Cite this Page
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 Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=114531-28-1 (retrieved ) (CAS RN: 114531-28-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
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
InChIKey
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]
Canonical SMILES
O=C(OC1C(=C)C2CCC13C4OC5N6CCOC6C7(C)CCCC5(C7C4)C3C2)C
Other Names for this Substance
- 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)-
- Isoatisine, 7,20-epoxy-, acetate (ester), (7α,15α,19S,20R)-
- 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*)]-
- Spiramine A
- Spiramine C acetate (ester)
