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Predict NMR spectrum
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| InChI: |
1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3 |
| InChIKey: |
VNONINPVFQTJOC-UHFFFAOYSA-N |
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| H donor: |
8 |
| H acceptor: |
16 |
| Rotatable bond: |
7 |
| Stereocenter: |
26 |
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| cLogP: |
1.213 |
| cLogS: |
-5.693 |
| Polar surface: |
235.68 |
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