| SpectraBase Compound ID | 2TPrO3i3tZz |
|---|---|
| InChI | InChI=1S/C66H62O12/c1-67-41-19-11-35(12-20-41)53-57-49(75-9)33-51-59(55(39-27-45(71-5)31-46(28-39)72-6)65(77-51)37-15-23-43(69-3)24-16-37)63(57)62-54(36-13-21-42(68-2)22-14-36)61(53)64-58(62)50(76-10)34-52-60(64)56(40-29-47(73-7)32-48(30-40)74-8)66(78-52)38-17-25-44(70-4)26-18-38/h11-34,53-56,61-62,65-66H,1-10H3/t53-,54-,55+,56-,61+,62-,65-,66+/m0/s1 |
| InChIKey | FDGRMSSHSWUWMZ-VSYGSNRKSA-N |
| Mol Weight | 1047.2 g/mol |
| Molecular Formula | C66H62O12 |
| Exact Mass | 1046.424127 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9M9L8qyNfyl |
|---|---|
| Name | Decamethylvatdiospyroidol |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C66H62O12 |
| InChI | InChI=1S/C66H62O12/c1-67-41-19-11-35(12-20-41)53-57-49(75-9)33-51-59(55(39-27-45(71-5)31-46(28-39)72-6)65(77-51)37-15-23-43(69-3)24-16-37)63(57)62-54(36-13-21-42(68-2)22-14-36)61(53)64-58(62)50(76-10)34-52-60(64)56(40-29-47(73-7)32-48(30-40)74-8)66(78-52)38-17-25-44(70-4)26-18-38/h11-34,53-56,61-62,65-66H,1-10H3/t53-,54-,55+,56-,61+,62-,65-,66+/m0/s1 |
| InChIKey | FDGRMSSHSWUWMZ-VSYGSNRKSA-N |
| Molecular Weight | 1047.210 g/mol |
| SMILES | c12c3[C@]([C@@](c4ccc(cc4)OC)([H])Oc3cc(c1[C@@]([C@]1([H])[C@@]([C@]2(c2c1c1[C@@]([C@](c3ccc(cc3)OC)([H])Oc1cc2OC)(c1cc(OC)cc(c1)OC)[H])[H])(c1ccc(cc1)OC)[H])(c1ccc(cc1)OC)[H])OC)(c1cc(OC)cc(c1)OC)[H] |
| SPLASH | splash10-0002-9000000000-10ec4b93ef76729fa5ef |
| Source of Spectrum | J-64-6982-3 |
| Wiley ID | 1531079 |