| SpectraBase Compound ID | 87NHc4933Jh |
|---|---|
| InChI | InChI=1S/C43H48N4O6/c1-49-29-9-5-7-27-31(29)47-23-40-21-24-20-38-13-18-51-30(38)10-15-45-16-12-42(27,35(38)45)43(24,47)53-37(40)46-17-11-41-26-6-3-4-8-28(26)44-32(41)25(33(48)50-2)22-39(34(41)46)14-19-52-36(39)40/h3-9,24,30,34-37,44H,10-23H2,1-2H3/t24-,30-,34-,35-,36+,37+,38+,39-,40+,41-,42+,43+/m0/s1 |
| InChIKey | RZBFPDQKWUWUCK-SFUBKHQQSA-N |
| Mol Weight | 716.9 g/mol |
| Molecular Formula | C43H48N4O6 |
| Exact Mass | 716.357385 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4vlFpDTRaK |
|---|---|
| Name | Amatain |
| CAS Registry Number | 31148-60-4 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C43H48N4O6 |
| InChI | InChI=1S/C43H48N4O6/c1-49-29-9-5-7-27-31(29)47-23-40-21-24-20-38-13-18-51-30(38)10-15-45-16-12-42(27,35(38)45)43(24,47)53-37(40)46-17-11-41-26-6-3-4-8-28(26)44-32(41)25(33(48)50-2)22-39(34(41)46)14-19-52-36(39)40/h3-9,24,30,34-37,44H,10-23H2,1-2H3/t24-,30-,34-,35-,36+,37+,38+,39-,40+,41-,42+,43+/m0/s1 |
| InChIKey | RZBFPDQKWUWUCK-SFUBKHQQSA-N |
| Molecular Weight | 716.879 g/mol |
| SMILES | N1c2c([C@]34C1=C(C[C@]15[C@]([C@]67C[C@@]8(C[C@]9%10[C@](CCN%11[C@@]9([C@@]9([C@@]8(O[C@]6(N([C@]41[H])CC3)[H])N(C7)c1c(OC)cccc91)CC%11)[H])(OCC%10)[H])[H])(OCC5)[H])C(=O)OC)cccc2 |
| SPLASH | splash10-014r-0504000900-ecc5695174d075c3e476 |
| Source of Spectrum | H-60-2855-1 |
| Synonyms | Amataine Grandifoline Grandifoline (hedranthera) Subsessiline (voacanga) |
| Wiley ID | 1415531 |