| SpectraBase Compound ID | 4IDP61PrzEY |
|---|---|
| InChI | InChI=1S/C37H62O8/c1-21(11-10-15-33(2,3)42)22-14-16-37(8)31-25(43-9)19-24-23(35(31,6)17-18-36(22,37)7)12-13-27(34(24,4)5)45-32-30(41)29(40)28(39)26(20-38)44-32/h10,15,19,21-23,25-32,38-42H,11-14,16-18,20H2,1-9H3/b15-10+/t21-,22-,23-,25+,26-,27+,28-,29-,30-,31-,32+,35+,36-,37+/m1/s1 |
| InChIKey | SQGCPGUUCGINMK-RWVJRPFNSA-N |
| Mol Weight | 634.9 g/mol |
| Molecular Formula | C37H62O8 |
| Exact Mass | 634.444469 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FmmCBSI6RrF |
|---|---|
| Name | KARAVILOSIDE-III;7-METHOXY-CUCURBITA-5,23-DIEN-3-BETA,25-DIOL-3-O-BETA-D-ALLOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H62O8 |
| InChI | InChI=1S/C37H62O8/c1-21(11-10-15-33(2,3)42)22-14-16-37(8)31-25(43-9)19-24-23(35(31,6)17-18-36(22,37)7)12-13-27(34(24,4)5)45-32-30(41)29(40)28(39)26(20-38)44-32/h10,15,19,21-23,25-32,38-42H,11-14,16-18,20H2,1-9H3/b15-10+/t21-,22-,23-,25+,26-,27+,28-,29-,30-,31-,32+,35+,36-,37+/m1/s1 |
| InChIKey | SQGCPGUUCGINMK-RWVJRPFNSA-N |
| Literature Reference Author | S.NAKAMURA,T.MURAKAMI,J.NAKAMURA,H.KOBAYASHI,H.MATSUDA,M.YOS HIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1545(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1545 |
| Molecular Weight | 634.894 g/mol |
| Sample ID | 55304 |
| Solvent | C5D5N |