| SpectraBase Compound ID | K094gMAbw3y |
|---|---|
| InChI | InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-13-16-29(6)21-11-12-23-27(3,4)24(31)14-15-28(23,5)22(21)17-25(32)30(20,29)7/h10-11,17-18,20,23,25,32H,8-9,12-16H2,1-7H3,(H,33,34)/b19-10-/t18-,20-,23?,25-,28-,29+,30+/m1/s1 |
| InChIKey | MUYQNDWZUCOTJV-XWMBNLATSA-N |
| Mol Weight | 468.7 g/mol |
| Molecular Formula | C30H44O4 |
| Exact Mass | 468.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1i5iKGmfrcK |
|---|---|
| Name | TYROMYCIC-ACID-D;3-OXO-12-BETA-HYDROXYLANOSTA-7,9(11),24(Z)-TRIEN-26-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O4 |
| InChI | InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-13-16-29(6)21-11-12-23-27(3,4)24(31)14-15-28(23,5)22(21)17-25(32)30(20,29)7/h10-11,17-18,20,23,25,32H,8-9,12-16H2,1-7H3,(H,33,34)/b19-10-/t18-,20-,23?,25-,28-,29+,30+/m1/s1 |
| InChIKey | MUYQNDWZUCOTJV-XWMBNLATSA-N |
| Literature Reference Author | D.N.QUANG,T.HASHIMOTO,M.TANAKA,S.TAKAOKA,Y.ASAKAWA |
| Literature Reference Citation | J.NAT.PROD.,67,148(2004) |
| Literature Reference DOI | 10.1021/np030264+ |
| Molecular Weight | 468.677 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP3506 |