| SpectraBase Compound ID | Ks6qmalAghY |
|---|---|
| InChI | InChI=1S/C67H78O34/c1-31-48(76)52(80)55(83)63(91-31)92-39-21-13-35(25-40(39)87-3)16-24-47(75)96-58-44(29-88-32(2)70)95-66(101-67(30-90-46(74)23-15-34-11-19-38(72)20-12-34)61(51(79)42(27-69)100-67)99-62(86)36-7-5-4-6-8-36)60(98-64-56(84)53(81)49(77)41(26-68)93-64)59(58)97-65-57(85)54(82)50(78)43(94-65)28-89-45(73)22-14-33-9-17-37(71)18-10-33/h4-25,31,41-44,48-61,63-66,68-69,71-72,76-85H,26-30H2,1-3H3/b22-14+,23-15+,24-16+/t31-,41+,42-,43+,44+,48-,49+,50+,51-,52+,53-,54-,55+,56+,57+,58+,59-,60+,61+,63-,64-,65-,66+,67+/m0/s1 |
| InChIKey | PYDWNGJBCOCYOG-RUONHDPMSA-N |
| Mol Weight | 1427.3 g/mol |
| Molecular Formula | C67H78O34 |
| Exact Mass | 1426.43745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F3RMRzE77kG |
|---|---|
| Name | DALMAISIOSE-I |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C67H78O34 |
| InChI | InChI=1S/C67H78O34/c1-31-48(76)52(80)55(83)63(91-31)92-39-21-13-35(25-40(39)87-3)16-24-47(75)96-58-44(29-88-32(2)70)95-66(101-67(30-90-46(74)23-15-34-11-19-38(72)20-12-34)61(51(79)42(27-69)100-67)99-62(86)36-7-5-4-6-8-36)60(98-64-56(84)53(81)49(77)41(26-68)93-64)59(58)97-65-57(85)54(82)50(78)43(94-65)28-89-45(73)22-14-33-9-17-37(71)18-10-33/h4-25,31,41-44,48-61,63-66,68-69,71-72,76-85H,26-30H2,1-3H3/b22-14+,23-15+,24-16+/t31-,41+,42-,43+,44+,48-,49+,50+,51-,52+,53-,54-,55+,56+,57+,58+,59-,60+,61+,63-,64-,65-,66+,67+/m0/s1 |
| InChIKey | PYDWNGJBCOCYOG-RUONHDPMSA-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 | 1427.336 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI4025 |