| SpectraBase Compound ID | LVbQslyaTBR |
|---|---|
| InChI | InChI=1S/C30H39ClO7/c1-15-12-22(38-26(35)16(15)2)17(3)20-14-25(37-18(4)32)30(36)21-13-24(34)29(31)10-7-8-23(33)28(29,6)19(21)9-11-27(20,30)5/h7-8,14,17,19,21-22,24-25,34,36H,9-13H2,1-6H3/t17-,19-,21+,22-,24+,25-,27+,28-,29-,30-/m0/s1 |
| InChIKey | YTYRPIHQJLEEEG-IESOVIBYSA-N |
| Mol Weight | 547.1 g/mol |
| Molecular Formula | C30H39ClO7 |
| Exact Mass | 546.238431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | COYorfw5yDc |
|---|---|
| Name | PHYSAGULIN-B |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H39ClO7 |
| InChI | InChI=1S/C30H39ClO7/c1-15-12-22(38-26(35)16(15)2)17(3)20-14-25(37-18(4)32)30(36)21-13-24(34)29(31)10-7-8-23(33)28(29,6)19(21)9-11-27(20,30)5/h7-8,14,17,19,21-22,24-25,34,36H,9-13H2,1-6H3/t17-,19-,21+,22-,24+,25-,27+,28-,29-,30-/m0/s1 |
| InChIKey | YTYRPIHQJLEEEG-IESOVIBYSA-N |
| Literature Reference Author | B.MAKINO,M.KAWAI,T.OGURA,M.NAKANISHI,H.YAMAMURA,Y.BUTSUGAN |
| Literature Reference Citation | J.NAT.PROD.,58,1668(1995) |
| Literature Reference DOI | 10.1021/np50125a004 |
| Molecular Weight | 547.088 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS23370 |