| SpectraBase Compound ID | 41qR8Ekb80w |
|---|---|
| InChI | InChI=1S/C38H55NO5/c1-23(9-8-10-24(2)35(41)39-34(36(42)44-7)26-11-13-27(43-6)14-12-26)29-17-18-31-28-15-16-30-25(3)33(40)20-22-38(30,5)32(28)19-21-37(29,31)4/h10-14,23,25,29-30,32-34,40H,8-9,15-22H2,1-7H3,(H,39,41)/b24-10+/t23-,25+,29?,30?,32?,33+,34+,37-,38+/m1/s1 |
| InChIKey | QCZDOJVNRIXLCD-VPJQVOISSA-N |
| Mol Weight | 605.9 g/mol |
| Molecular Formula | C38H55NO5 |
| Exact Mass | 605.408024 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EkohbIuBZZt |
|---|---|
| Name | Polymastiamide C - Methyl Ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H55NO5 |
| InChI | InChI=1S/C38H55NO5/c1-23(9-8-10-24(2)35(41)39-34(36(42)44-7)26-11-13-27(43-6)14-12-26)29-17-18-31-28-15-16-30-25(3)33(40)20-22-38(30,5)32(28)19-21-37(29,31)4/h10-14,23,25,29-30,32-34,40H,8-9,15-22H2,1-7H3,(H,39,41)/b24-10+/t23-,25+,29?,30?,32?,33+,34+,37-,38+/m1/s1 |
| InChIKey | QCZDOJVNRIXLCD-VPJQVOISSA-N |
| Molecular Weight | 605.860 g/mol |
| SMILES | N(C(\C(=C\CC[C@](C1[C@@]2(C(=C3CCC4[C@@]([C@](CC[C@@]4(C3CC2)C)(O)[H])(C)[H])CC1)C)(C)[H])C)=O)[C@](C(=O)OC)(c1ccc(cc1)OC)[H] |
| SPLASH | splash10-002f-0900001000-cc48758c7fc19a1a825b |
| Source of Spectrum | G4-59-384-9 |
| Wiley ID | 1606286 |