| SpectraBase Compound ID | JlvjwX0igTf |
|---|---|
| InChI | InChI=1S/C66H108O31/c1-25-36(70)41(75)45(79)55(88-25)95-52-37(71)26(2)87-54(49(52)83)86-24-32-39(73)43(77)47(81)58(92-32)94-51-31(23-69)91-56(48(82)44(51)78)93-35-13-14-63(7)33(62(35,5)6)12-15-65(9)34(63)11-10-27-28-20-61(3,4)16-18-66(28,19-17-64(27,65)8)60(85)97-59-50(84)53(40(74)30(22-68)90-59)96-57-46(80)42(76)38(72)29(21-67)89-57/h10,25-26,28-59,67-84H,11-24H2,1-9H3/t25-,26-,28+,29-,30-,31-,32+,33+,34-,35+,36-,37-,38-,39-,40-,41+,42+,43-,44-,45+,46-,47+,48-,49+,50-,51-,52+,53+,54+,55-,56+,57+,58-,59+,63?,64?,65?,66+/m1/s1 |
| InChIKey | CNWYBBWOUDTJQX-TUTQOCHBSA-N |
| Mol Weight | 1397.6 g/mol |
| Molecular Formula | C66H108O31 |
| Exact Mass | 1396.687457 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6a4DU1eoqk6 |
|---|---|
| Name | 3-BETA-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-OLEAN-12-EN-28-OIC_ACID |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C66H108O31 |
| InChI | InChI=1S/C66H108O31/c1-25-36(70)41(75)45(79)55(88-25)95-52-37(71)26(2)87-54(49(52)83)86-24-32-39(73)43(77)47(81)58(92-32)94-51-31(23-69)91-56(48(82)44(51)78)93-35-13-14-63(7)33(62(35,5)6)12-15-65(9)34(63)11-10-27-28-20-61(3,4)16-18-66(28,19-17-64(27,65)8)60(85)97-59-50(84)53(40(74)30(22-68)90-59)96-57-46(80)42(76)38(72)29(21-67)89-57/h10,25-26,28-59,67-84H,11-24H2,1-9H3/t25-,26-,28+,29-,30-,31-,32+,33+,34-,35+,36-,37-,38-,39-,40-,41+,42+,43-,44-,45+,46-,47+,48-,49+,50-,51-,52+,53+,54+,55-,56+,57+,58-,59+,63?,64?,65?,66+/m1/s1 |
| InChIKey | CNWYBBWOUDTJQX-TUTQOCHBSA-N |
| Literature Reference Author | N.D.TOMMASI,C.PIZZA,A.BELLINO,P.VENTURELLA |
| Literature Reference Citation | J.NAT.PROD.,60,1070(1997) |
| Literature Reference DOI | 10.1021/np970263f |
| Molecular Weight | 1397.565 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ11947 |