SpectraBase Compound ID | Kf0fnLnxoH2 |
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InChI | InChI=1S/C54H86O24/c1-49(2)13-15-54(16-14-52(5)23(24(54)17-49)7-8-30-50(3)11-10-31(59)51(4,22-58)29(50)9-12-53(30,52)6)48(70)78-46-41(69)42(35(63)28(75-46)21-71-44-39(67)36(64)32(60)25(18-55)72-44)76-47-43(38(66)34(62)27(20-57)74-47)77-45-40(68)37(65)33(61)26(19-56)73-45/h7,22,24-47,55-57,59-69H,8-21H2,1-6H3/t24-,25+,26+,27+,28+,29+,30+,31-,32+,33+,34-,35-,36-,37-,38-,39+,40+,41+,42-,43+,44+,45-,46-,47-,50?,51-,52?,53?,54-/m0/s1 |
InChIKey | NTCKUJLAAXBHCK-UBENEYGSSA-N |
Mol Weight | 1119.3 g/mol |
Molecular Formula | C54H86O24 |
Exact Mass | 1118.550904 g/mol |
SpectraBase Spectrum ID | KhDdyh3WUSY |
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Name | #2;3-BETA-HYDROXY-OLEAN-12-EN-23-OXO-28-OIC-ACID-28-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->3)]-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GALAC |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C54H86O24 |
InChI | InChI=1S/C54H86O24/c1-49(2)13-15-54(16-14-52(5)23(24(54)17-49)7-8-30-50(3)11-10-31(59)51(4,22-58)29(50)9-12-53(30,52)6)48(70)78-46-41(69)42(35(63)28(75-46)21-71-44-39(67)36(64)32(60)25(18-55)72-44)76-47-43(38(66)34(62)27(20-57)74-47)77-45-40(68)37(65)33(61)26(19-56)73-45/h7,22,24-47,55-57,59-69H,8-21H2,1-6H3/t24-,25+,26+,27+,28+,29+,30+,31-,32+,33+,34-,35-,36-,37-,38-,39+,40+,41+,42-,43+,44+,45-,46-,47-,50?,51-,52?,53?,54-/m0/s1 |
InChIKey | NTCKUJLAAXBHCK-UBENEYGSSA-N |
Literature Reference Author | M.H.A.ELGAMAL,H.S.M.SOLIMAN,M.S.KARAWYA,B.MIKHOVA,H.DUDDECK |
Literature Reference Citation | PHYTOCHEM.,38,1481(1995) |
Literature Reference DOI | 10.1016/0031-9422(94)00900-E |
Molecular Weight | 1119.262 g/mol |
Solvent | C5D5N |
Source File Reference | UWMS4060 |