| SpectraBase Compound ID | JJK2Ut8qR4j |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-8-35-27(33)30(34)16-29(7)22-13-14-28(6)20(19(5)10-9-18(4)17(2)3)11-12-21(28)25(22)24(31)15-23(29)26(30)32/h15,17,19-22,24-25,31,34H,4,8-14,16H2,1-3,5-7H3/t19-,20-,21+,22+,24+,25+,28-,29-,30+/m1/s1 |
| InChIKey | LKLMYTMGXXZKRG-VVBKSPELSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FPwEfAx9CN5 |
|---|---|
| Name | 2-ETHOXYCARBONYL-2-BETA,7-BETA-DIHYDROXY-A-NOR-ERGOSTA-5,24-(28)-DIEN-5-ONE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-8-35-27(33)30(34)16-29(7)22-13-14-28(6)20(19(5)10-9-18(4)17(2)3)11-12-21(28)25(22)24(31)15-23(29)26(30)32/h15,17,19-22,24-25,31,34H,4,8-14,16H2,1-3,5-7H3/t19-,20-,21+,22+,24+,25+,28-,29-,30+/m1/s1 |
| InChIKey | LKLMYTMGXXZKRG-VVBKSPELSA-N |
| Literature Reference Author | S.YU,Z.DENG,P.PROKSCH,W.LIN |
| Literature Reference Citation | J.NAT.PROD.,69,1330(2006) |
| Literature Reference DOI | 10.1021/np0600494 |
| Molecular Weight | 486.692 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ15508 |