| SpectraBase Compound ID | 13JvBeZ0mHN |
|---|---|
| InChI | InChI=1S/C51H88O28/c1-19(11-9-13-21(3)18-69-51-45(79-49-41(67)37(63)31(57)25(7)73-49)43(33(59)27(17-53)75-51)77-47-39(65)35(61)29(55)23(5)71-47)10-8-12-20(2)14-15-68-50-44(78-48-40(66)36(62)30(56)24(6)72-48)42(32(58)26(16-52)74-50)76-46-38(64)34(60)28(54)22(4)70-46/h10,14,21-67H,8-9,11-13,15-18H2,1-7H3/b19-10+,20-14+/t21-,22+,23-,24-,25+,26-,27+,28+,29-,30-,31+,32-,33+,34-,35+,36+,37-,38-,39+,40+,41-,42+,43-,44-,45+,46+,47-,48-,49+,50-,51+/m0/s1 |
| InChIKey | CEHGKENYDAWPIF-AUJFPPAMSA-N |
| Mol Weight | 1149.2 g/mol |
| Molecular Formula | C51H88O28 |
| Exact Mass | 1148.546212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 35EuzXCyQwD |
|---|---|
| Name | MUKUROZIOSIDE-IIA |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H88O28 |
| InChI | InChI=1S/C51H88O28/c1-19(11-9-13-21(3)18-69-51-45(79-49-41(67)37(63)31(57)25(7)73-49)43(33(59)27(17-53)75-51)77-47-39(65)35(61)29(55)23(5)71-47)10-8-12-20(2)14-15-68-50-44(78-48-40(66)36(62)30(56)24(6)72-48)42(32(58)26(16-52)74-50)76-46-38(64)34(60)28(54)22(4)70-46/h10,14,21-67H,8-9,11-13,15-18H2,1-7H3/b19-10+,20-14+/t21-,22+,23-,24-,25+,26-,27+,28+,29-,30-,31+,32-,33+,34-,35+,36+,37-,38-,39+,40+,41-,42+,43-,44-,45+,46+,47-,48-,49+,50-,51+/m0/s1 |
| InChIKey | CEHGKENYDAWPIF-AUJFPPAMSA-N |
| Literature Reference Author | T.MORIKAWA,Y.XIE,K.NINOMIYA,M.OKAMOTO,O.MURAOKA,D.YUAN,M.YOS HIKAWA,T.HAYAKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,58,1276(2010) |
| Literature Reference DOI | 10.1248/cpb.58.1276 |
| Molecular Weight | 1149.243 g/mol |
| Source File Reference | UWBT3917 |