| SpectraBase Compound ID | CBU6msyV2DB |
|---|---|
| InChI | InChI=1S/C44H64O14/c1-25-11-13-31-41(3)15-9-17-43(31,5)29(25)21-55-35(39(51)53-7)27(19-33(45)46)37(49)58-24-42(4)16-10-18-44(6)30(26(2)12-14-32(42)44)22-56-36(40(52)54-8)28(20-34(47)48)38(50)57-23-41/h27-32,35-36H,1-2,9-24H2,3-8H3,(H,45,46)(H,47,48)/t27-,28-,29-,30+,31?,32?,35-,36-,41-,42+,43+,44-/m1/s1 |
| InChIKey | OXFMLGZWGZNFCM-HZPSACOKSA-N |
| Mol Weight | 817.0 g/mol |
| Molecular Formula | C44H64O14 |
| Exact Mass | 816.429607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 58S3Ry5hey7 |
|---|---|
| Name | CRYPTOPORIC-ACID-D;CA-D |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H64O14 |
| InChI | InChI=1S/C44H64O14/c1-25-11-13-31-41(3)15-9-17-43(31,5)29(25)21-55-35(39(51)53-7)27(19-33(45)46)37(49)58-24-42(4)16-10-18-44(6)30(26(2)12-14-32(42)44)22-56-36(40(52)54-8)28(20-34(47)48)38(50)57-23-41/h27-32,35-36H,1-2,9-24H2,3-8H3,(H,45,46)(H,47,48)/t27-,28-,29-,30+,31?,32?,35-,36-,41-,42+,43+,44-/m1/s1 |
| InChIKey | OXFMLGZWGZNFCM-HZPSACOKSA-N |
| Literature Reference Author | Y.ASAKAWA,T.HASHIMOTO,Y.MIZUNO,M.TORI,Y.FUKAZAWA |
| Literature Reference Citation | PHYTOCHEM.,31,579(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)90042-O |
| Molecular Weight | 816.984 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU6109 |