| SpectraBase Compound ID | LyKvgkPs4rI |
|---|---|
| InChI | InChI=1S/C29H49NO5/c1-17(31)21-11-14-29(32)23-8-7-19-15-20(9-12-27(19,3)22(23)10-13-28(21,29)4)35-25-16-24(33-6)26(30-5)18(2)34-25/h18-26,30,32H,7-16H2,1-6H3/t18?,19?,20-,21?,22+,23-,24?,25?,26?,27+,28-,29+/m1/s1 |
| InChIKey | VPLNNEMLBWLRFQ-XREFGCPASA-N |
| Mol Weight | 491.7 g/mol |
| Molecular Formula | C29H49NO5 |
| Exact Mass | 491.361074 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IEGw539LTFe |
|---|---|
| Name | 17-epi-holacurtine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H49NO5 |
| InChI | InChI=1S/C29H49NO5/c1-17(31)21-11-14-29(32)23-8-7-19-15-20(9-12-27(19,3)22(23)10-13-28(21,29)4)35-25-16-24(33-6)26(30-5)18(2)34-25/h18-26,30,32H,7-16H2,1-6H3/t18?,19?,20-,21?,22+,23-,24?,25?,26?,27+,28-,29+/m1/s1 |
| InChIKey | VPLNNEMLBWLRFQ-XREFGCPASA-N |
| Molecular Weight | 491.713 g/mol |
| SMILES | N(C1C(OC(O[C@@]2(CC[C@@]3([C@]4(CC[C@]5([C@](CCC5C(=O)C)([C@@]4(CCC3C2)[H])O)C)[H])C)[H])CC1OC)C)C |
| SPLASH | splash10-014i-0349500000-f3095dda14111cae50fe |
| Source of Spectrum | G4-61-1335-3 |
| Wiley ID | 1607494 |