| SpectraBase Compound ID | 5B0S3WQPjBR |
|---|---|
| InChI | InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15?,16?,23-,26?,27+,28-,29-,30?,33?,34-,35+,36+/m1/s1 |
| InChIKey | IMIAGCONYJPMDY-UHFFFAOYSA-N |
| Mol Weight | 761.7 g/mol |
| Molecular Formula | C36H43NO17 |
| Exact Mass | 761.253099 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3IJnOSh8KWp |
|---|---|
| Name | Evonine |
| CAS Registry Number | 33458-64-9 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C36H43NO17 |
| InChI | InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15?,16?,23-,26?,27+,28-,29-,30?,33?,34-,35+,36+/m1/s1 |
| InChIKey | IMIAGCONYJPMDY-UHFFFAOYSA-N |
| Molecular Weight | 761.730 g/mol |
| SMILES | O[C@]1([C@@]23[C@]4([C@](OC(=O)C)(C([C@]([C@@]3(OC(=O)C)[H])(C(O2)(COC(c2c(nccc2)C(C(C(O[C@@]1(C(OC(=O)C)C4OC(=O)C)[H])=O)C)C)=O)C)[H])=O)[H])COC(=O)C)C |
| SPLASH | splash10-0a4l-2920000000-0b8dba5e601b7183bb89 |
| Source of Spectrum | G-38-2135-2 |
| Synonyms | 8,11-Epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[4,3-b]pyridine-5,17,22-trione, 10,13,14,21-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-7,8,9,10,12,13,14,15,18,19-decahydro-20-hydroxy-8,18,19,20-tetramethyl- 8,11-Epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[4,3-b]pyridine-5,17,22-trione, 10,13,14,21-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-7,8,9,10,12,13,14,15,18,19-decahydro-20-hydroxy-8,18,19,20-tetramethyl-, (8R,9R,10R,11S,12S,13R,14R,15S,18S,19S,20S,21S)- |
| Wiley ID | 1416534 |