| SpectraBase Compound ID | 30QW8NMUxTC |
|---|---|
| InChI | InChI=1S/C33H46O8/c1-16(18(3)31(38)39)9-10-17(2)22-11-12-23-27-25(36)15-24-19(4)26(40-20(5)34)13-14-32(24,7)28(27)29(37)30(33(22,23)8)41-21(6)35/h17-19,22-24,26,30H,1,9-15H2,2-8H3,(H,38,39)/t17-,18?,19+,22-,23+,24?,26-,30+,32+,33-/m1/s1 |
| InChIKey | ALSDSAQWFABGRX-ITVYWXGOSA-N |
| Mol Weight | 570.7 g/mol |
| Molecular Formula | C33H46O8 |
| Exact Mass | 570.319268 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GXKf4LFu2Ch |
|---|---|
| Name | ZHANKUIC-ACID-C-DIACETATE;3-ALPHA,12-ALPHA-DIACETOXY4-ALPHA-METHYL-ERGOSTA-8,24(28)-DIEN-7,11-DIONE-26-OIC-ACID |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H46O8 |
| InChI | InChI=1S/C33H46O8/c1-16(18(3)31(38)39)9-10-17(2)22-11-12-23-27-25(36)15-24-19(4)26(40-20(5)34)13-14-32(24,7)28(27)29(37)30(33(22,23)8)41-21(6)35/h17-19,22-24,26,30H,1,9-15H2,2-8H3,(H,38,39)/t17-,18?,19+,22-,23+,24?,26-,30+,32+,33-/m1/s1 |
| InChIKey | ALSDSAQWFABGRX-ITVYWXGOSA-N |
| Literature Reference Author | C.H.CHEN,S.W.YANG,Y.C.SHEN |
| Literature Reference Citation | J.NAT.PROD.,58,1655(1995) |
| Literature Reference DOI | 10.1021/np50125a002 |
| Molecular Weight | 570.723 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS22804 |