| SpectraBase Compound ID | ARkmqb9gSGp |
|---|---|
| InChI | InChI=1S/C62H82O32/c1-16-38-41(44(57(74)76-14)23-82-59(38)93-61-55(88-36(12)70)53(86-34(10)68)51(84-32(8)66)47(91-61)25-79-30(6)64)19-49(72)81-22-43-28(4)46(18-40(43)27(3)21-78-29(5)63)90-50(73)20-42-39(17-2)60(83-24-45(42)58(75)77-15)94-62-56(89-37(13)71)54(87-35(11)69)52(85-33(9)67)48(92-62)26-80-31(7)65/h16-17,23-24,27-28,40-43,46-48,51-56,59-62H,18-22,25-26H2,1-15H3/b38-16-,39-17+/t27?,28-,40-,41?,42?,43+,46-,47-,48-,51-,52-,53+,54+,55-,56-,59?,60?,61+,62+/m1/s1 |
| InChIKey | WXAXWUULXVAATJ-FIHJVWGXSA-N |
| Mol Weight | 1339.3 g/mol |
| Molecular Formula | C62H82O32 |
| Exact Mass | 1338.47892 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GCm10pELRa5 |
|---|---|
| Name | JASUROSIDE-A-NONAACETATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C62H82O32 |
| InChI | InChI=1S/C62H82O32/c1-16-38-41(44(57(74)76-14)23-82-59(38)93-61-55(88-36(12)70)53(86-34(10)68)51(84-32(8)66)47(91-61)25-79-30(6)64)19-49(72)81-22-43-28(4)46(18-40(43)27(3)21-78-29(5)63)90-50(73)20-42-39(17-2)60(83-24-45(42)58(75)77-15)94-62-56(89-37(13)71)54(87-35(11)69)52(85-33(9)67)48(92-62)26-80-31(7)65/h16-17,23-24,27-28,40-43,46-48,51-56,59-62H,18-22,25-26H2,1-15H3/b38-16-,39-17+/t27?,28-,40-,41?,42?,43+,46-,47-,48-,51-,52-,53+,54+,55-,56-,59?,60?,61+,62+/m1/s1 |
| InChIKey | WXAXWUULXVAATJ-FIHJVWGXSA-N |
| Literature Reference Author | Y.C.SHEN,P.W.HSIEH |
| Literature Reference Citation | J.NAT.PROD.,60,453(1997) |
| Literature Reference DOI | 10.1021/np960719d |
| Molecular Weight | 1339.314 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ126 |