![1-BETA,3-BETA-DIHYDROXYPREGNA-5,16-DIEN-20-ONE-1-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-ALPHA-L-ARABINOPYRANOSIDE]](/api/spectrum/1vLLs8ma2X1/structure.png?h=300&w=458 "1-BETA,3-BETA-DIHYDROXYPREGNA-5,16-DIEN-20-ONE-1-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-ALPHA-L-ARABINOPYRANOSIDE]")
| SpectraBase Compound ID | nzbg3qhIi2 |
|---|---|
| InChI | InChI=1S/C37H56O15/c1-15(38)20-7-8-21-19-6-5-17-11-18(39)12-25(37(17,4)22(19)9-10-36(20,21)3)50-35-32(52-34-30(46)28(44)26(42)16(2)49-34)31(24(41)14-48-35)51-33-29(45)27(43)23(40)13-47-33/h5,7,16,18-19,21-35,39-46H,6,8-14H2,1-4H3/t16-,18-,19?,21?,22?,23-,24-,25-,26-,27+,28+,29-,30+,31-,32+,33+,34-,35-,36-,37+/m1/s1 |
| InChIKey | XUKYFUGWFDHJME-HGAOTCSTSA-N |
| Mol Weight | 740.8 g/mol |
| Molecular Formula | C37H56O15 |
| Exact Mass | 740.361921 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1vLLs8ma2X1 |
|---|---|
| Name | 1-BETA,3-BETA-DIHYDROXYPREGNA-5,16-DIEN-20-ONE-1-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-ALPHA-L-ARABINOPYRANOSIDE] |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H56O15 |
| InChI | InChI=1S/C37H56O15/c1-15(38)20-7-8-21-19-6-5-17-11-18(39)12-25(37(17,4)22(19)9-10-36(20,21)3)50-35-32(52-34-30(46)28(44)26(42)16(2)49-34)31(24(41)14-48-35)51-33-29(45)27(43)23(40)13-47-33/h5,7,16,18-19,21-35,39-46H,6,8-14H2,1-4H3/t16-,18-,19?,21?,22?,23-,24-,25-,26-,27+,28+,29-,30+,31-,32+,33+,34-,35-,36-,37+/m1/s1 |
| InChIKey | XUKYFUGWFDHJME-HGAOTCSTSA-N |
| Literature Reference Author | Y.MIMAKI,T.INOUE,M.HURODA,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,44,107(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00477-3 |
| Molecular Weight | 740.843 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWUC206 |