![3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-METHYLESTER](/api/spectrum/6LjNAskuzOf/structure.png?h=300&w=458 "3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-METHYLESTER")
| SpectraBase Compound ID | Kc6AkC5hj1g |
|---|---|
| InChI | InChI=1S/C44H70O14/c1-39(2)16-18-44(38(52)54-9)19-17-42(6)22(23(44)20-39)10-11-26-41(5)14-13-27(40(3,4)25(41)12-15-43(26,42)7)56-37-32(50)30(48)33(34(58-37)35(51)53-8)57-36-31(49)29(47)28(46)24(21-45)55-36/h10,23-34,36-37,45-50H,11-21H2,1-9H3/t23?,24-,25?,26?,27-,28-,29+,30+,31-,32+,33-,34-,36+,37+,41-,42+,43+,44-/m0/s1 |
| InChIKey | PEERNMNKZXLAEF-QZTLCPRJSA-N |
| Mol Weight | 823.0 g/mol |
| Molecular Formula | C44H70O14 |
| Exact Mass | 822.476557 g/mol |
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| SpectraBase Spectrum ID | 6LjNAskuzOf |
|---|---|
| Name | 3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-METHYLESTER |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H70O14 |
| InChI | InChI=1S/C44H70O14/c1-39(2)16-18-44(38(52)54-9)19-17-42(6)22(23(44)20-39)10-11-26-41(5)14-13-27(40(3,4)25(41)12-15-43(26,42)7)56-37-32(50)30(48)33(34(58-37)35(51)53-8)57-36-31(49)29(47)28(46)24(21-45)55-36/h10,23-34,36-37,45-50H,11-21H2,1-9H3/t23?,24-,25?,26?,27-,28-,29+,30+,31-,32+,33-,34-,36+,37+,41-,42+,43+,44-/m0/s1 |
| InChIKey | PEERNMNKZXLAEF-QZTLCPRJSA-N |
| Literature Reference Author | V.D.HUAN,S.YAMAMURA,K.OHTANI,R.KASAI,K.YAMASAKI,N.T.NHAM,H.M .CHAU |
| Literature Reference Citation | PHYTOCHEM.,47,451(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00618-3 |
| Molecular Weight | 823.031 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS184 |