SpectraBase Compound ID | 5kro1S1FWYd |
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InChI | InChI=1S/C59H94O25/c1-11-24(2)49(75)79-34-20-54(4,5)18-27-26-12-13-31-56(8)16-15-33(55(6,7)30(56)14-17-57(31,9)58(26,10)19-32(63)59(27,34)23-62)80-53-47(84-51-42(71)39(68)36(65)28(21-60)77-51)44(43(72)45(82-53)48(73)74)81-52-46(40(69)37(66)29(22-61)78-52)83-50-41(70)38(67)35(64)25(3)76-50/h11-12,25,27-47,50-53,60-72H,13-23H2,1-10H3,(H,73,74)/b24-11-/t25-,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+,56-,57+,58+,59-/m0/s1 |
InChIKey | GKKTUPILOBPVDV-CNBLQMPKSA-N |
Mol Weight | 1203.4 g/mol |
Molecular Formula | C59H94O25 |
Exact Mass | 1202.608419 g/mol |
SpectraBase Spectrum ID | 4FAmGmZeFa3 |
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Name | #2;MAETENOSIDE-B;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->3)]-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL-CAMELLIAGENIN-A-2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C59H94O25 |
InChI | InChI=1S/C59H94O25/c1-11-24(2)49(75)79-34-20-54(4,5)18-27-26-12-13-31-56(8)16-15-33(55(6,7)30(56)14-17-57(31,9)58(26,10)19-32(63)59(27,34)23-62)80-53-47(84-51-42(71)39(68)36(65)28(21-60)77-51)44(43(72)45(82-53)48(73)74)81-52-46(40(69)37(66)29(22-61)78-52)83-50-41(70)38(67)35(64)25(3)76-50/h11-12,25,27-47,50-53,60-72H,13-23H2,1-10H3,(H,73,74)/b24-11-/t25-,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+,56-,57+,58+,59-/m0/s1 |
InChIKey | GKKTUPILOBPVDV-CNBLQMPKSA-N |
Literature Reference Author | K.KOIKE,Z.JIA,T.NIKAIDO |
Literature Reference Citation | CHEM.PHARM.BULL.,49,758(2001) |
Literature Reference DOI | 10.1248/cpb.49.758 |
Molecular Weight | 1203.380 g/mol |
Solvent | C5D5N |
Source File Reference | UWLU31734 |