| SpectraBase Compound ID | J96gXKBaYVR |
|---|---|
| InChI | InChI=1S/C27H30O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19-23,25,28-31,34H,6,12,14-15H2/t19-,20?,21-,22+,23-,25-,27?/m1/s1 |
| InChIKey | VMTVSRVEQGYRCZ-FQABINTDSA-N |
| Mol Weight | 530.53 g/mol |
| Molecular Formula | C27H30O11 |
| Exact Mass | 530.178812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2cjaosMd1GR |
|---|---|
| Name | TREMULACINOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O11 |
| InChI | InChI=1S/C27H30O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19-23,25,28-31,34H,6,12,14-15H2/t19-,20?,21-,22+,23-,25-,27?/m1/s1 |
| InChIKey | VMTVSRVEQGYRCZ-FQABINTDSA-N |
| Literature Reference Author | T.ISHIKAWA,K.NISHIGAYA,K.TAKAMI,H.UCHIKOSHI,I.S.CHEN,I.L.TSA I |
| Literature Reference Citation | J.NAT.PROD.,67,659(2004) |
| Literature Reference DOI | 10.1021/np034052o |
| Molecular Weight | 530.529 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ7005 |