SpectraBase Compound ID | 3aq3lGFz0HL |
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InChI | InChI=1S/C49H78O19/c1-44(2)15-17-49(43(61)68-41-36(59)32(55)30(53)25(21-51)64-41)18-16-47(6)22(23(49)19-44)9-10-27-46(5)13-12-28(45(3,4)26(46)11-14-48(27,47)7)65-42-38(34(57)33(56)37(66-42)39(60)62-8)67-40-35(58)31(54)29(52)24(20-50)63-40/h9,23-38,40-42,50-59H,10-21H2,1-8H3/t23?,24-,25-,26?,27?,28?,29+,30-,31+,32+,33+,34+,35-,36-,37+,38-,40+,41+,42?,46+,47-,48-,49+/m0/s1 |
InChIKey | PYRYQDQZMLGNFX-JRLRCUOESA-N |
Mol Weight | 971.1 g/mol |
Molecular Formula | C49H78O19 |
Exact Mass | 970.51373 g/mol |
SpectraBase Spectrum ID | LDY7kGk6Uk1 |
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Name | 3-O-[beta-D-GALACTOPYRANOSYL(1-2)-beta-D-GLUCURONOPYRANOSYL]- 28-O-beta-D-GLUCOPYRANOSYL OLEAN-12-ENE-28-OIC ACID |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C49H78O19 |
InChI | InChI=1S/C49H78O19/c1-44(2)15-17-49(43(61)68-41-36(59)32(55)30(53)25(21-51)64-41)18-16-47(6)22(23(49)19-44)9-10-27-46(5)13-12-28(45(3,4)26(46)11-14-48(27,47)7)65-42-38(34(57)33(56)37(66-42)39(60)62-8)67-40-35(58)31(54)29(52)24(20-50)63-40/h9,23-38,40-42,50-59H,10-21H2,1-8H3/t23?,24-,25-,26?,27?,28?,29+,30-,31+,32+,33+,34+,35-,36-,37+,38-,40+,41+,42?,46+,47-,48-,49+/m0/s1 |
InChIKey | PYRYQDQZMLGNFX-JRLRCUOESA-N |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |