| SpectraBase Compound ID | 8lvXfr2ggI4 |
|---|---|
| InChI | InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)35-6)27(31,23(26)28)22(21(24)26)36-14(2)29/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23?,24+,25-,26+,27-/m1/s1 |
| InChIKey | BXWPDMXKEZYVBB-VEUWJJFUSA-N |
| Mol Weight | 509.6 g/mol |
| Molecular Formula | C27H43NO8 |
| Exact Mass | 509.298867 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9kGjF7uQJqf |
|---|---|
| Name | Leucostine A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H43NO8 |
| InChI | InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)35-6)27(31,23(26)28)22(21(24)26)36-14(2)29/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23?,24+,25-,26+,27-/m1/s1 |
| InChIKey | BXWPDMXKEZYVBB-VEUWJJFUSA-N |
| Molecular Weight | 509.640 g/mol |
| SMILES | O[C@]12[C@@]3(C4[C@]5([C@@]6(C[C@@]([C@@]([C@]26[H])(OC)[H])([C@](C1)(OC)[H])[H])[H])[C@@]([C@](CN4CC)(CC[C@@]5(OC)[H])COC)([C@@]3(OC(=O)C)[H])[H])O |
| SPLASH | splash10-004i-0000900000-525965dfc6607cbd751a |
| Source of Spectrum | G4-59-279-1 |
| Synonyms | (1alpha,6beta,14alpha,16beta)-20-ethyl-7,8-dihydroxy-1,14,16-trimethoxy-4-(methoxymethyl)aconitan-6-yl acetate |
| Wiley ID | 1606212 |