| SpectraBase Compound ID | 857IaSRd2zG |
|---|---|
| InChI | InChI=1S/C68H80O35/c1-31-49(77)53(81)56(84)64(93-31)94-39-20-13-35(25-41(39)89-4)16-23-48(76)98-59-45(29-90-32(2)71)97-67(103-68(30-92-47(75)22-15-34-12-19-38(73)40(24-34)88-3)62(52(80)43(27-70)102-68)101-63(87)36-8-6-5-7-9-36)61(100-65-57(85)54(82)50(78)42(26-69)95-65)60(59)99-66-58(86)55(83)51(79)44(96-66)28-91-46(74)21-14-33-10-17-37(72)18-11-33/h5-25,31,42-45,49-62,64-67,69-70,72-73,77-86H,26-30H2,1-4H3/b21-14+,22-15+,23-16+/t31-,42-,43+,44-,45-,49-,50-,51-,52+,53+,54+,55+,56-,57-,58-,59-,60+,61-,62-,64+,65+,66+,67-,68-/m1/s1 |
| InChIKey | QTQTWOLEYZGYSQ-UKLTXDDQSA-N |
| Mol Weight | 1457.4 g/mol |
| Molecular Formula | C68H80O35 |
| Exact Mass | 1456.448014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EpLEhnIqRnK |
|---|---|
| Name | DALMAISIOSE-K |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H80O35 |
| InChI | InChI=1S/C68H80O35/c1-31-49(77)53(81)56(84)64(93-31)94-39-20-13-35(25-41(39)89-4)16-23-48(76)98-59-45(29-90-32(2)71)97-67(103-68(30-92-47(75)22-15-34-12-19-38(73)40(24-34)88-3)62(52(80)43(27-70)102-68)101-63(87)36-8-6-5-7-9-36)61(100-65-57(85)54(82)50(78)42(26-69)95-65)60(59)99-66-58(86)55(83)51(79)44(96-66)28-91-46(74)21-14-33-10-17-37(72)18-11-33/h5-25,31,42-45,49-62,64-67,69-70,72-73,77-86H,26-30H2,1-4H3/b21-14+,22-15+,23-16+/t31-,42-,43+,44-,45-,49-,50-,51-,52+,53+,54+,55+,56-,57-,58-,59-,60+,61-,62-,64+,65+,66+,67-,68-/m1/s1 |
| InChIKey | QTQTWOLEYZGYSQ-UKLTXDDQSA-N |
| Literature Reference Author | S.KOBAYASHI,T.MIYASE,H.NOGUCHI |
| Literature Reference Citation | J.NAT.PROD.,65,319(2002) |
| Literature Reference DOI | 10.1021/np010434n |
| Molecular Weight | 1457.362 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI4027 |