SpectraBase Compound ID | 3SIDeOjY44p |
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InChI | InChI=1S/C60H96O27/c1-23-32(62)35(65)39(69)50(79-23)84-45-27(21-61)81-49(42(72)38(45)68)78-22-28-34(64)37(67)41(71)52(82-28)87-54(77)60-18-16-55(3,4)20-26(60)25-10-11-30-57(7)14-13-31(56(5,6)29(57)12-15-59(30,9)58(25,8)17-19-60)83-53-44(74)46(43(73)47(86-53)48(75)76)85-51-40(70)36(66)33(63)24(2)80-51/h10,23-24,26-47,49-53,61-74H,11-22H2,1-9H3,(H,75,76)/t23-,24+,26+,27-,28-,29+,30-,31+,32-,33+,34-,35+,36-,37+,38-,39+,40-,41-,42-,43+,44-,45-,46+,47+,49-,50-,51+,52+,53-,57+,58-,59-,60+/m1/s1 |
InChIKey | QFJJUJQDKVYMLM-KGBXKRPPSA-N |
Mol Weight | 1249.4 g/mol |
Molecular Formula | C60H96O27 |
Exact Mass | 1248.613898 g/mol |
SpectraBase Spectrum ID | LbtnuDI7lyU |
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Name | #15;COLCHISIDE-B;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOP |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C60H96O27 |
InChI | InChI=1S/C60H96O27/c1-23-32(62)35(65)39(69)50(79-23)84-45-27(21-61)81-49(42(72)38(45)68)78-22-28-34(64)37(67)41(71)52(82-28)87-54(77)60-18-16-55(3,4)20-26(60)25-10-11-30-57(7)14-13-31(56(5,6)29(57)12-15-59(30,9)58(25,8)17-19-60)83-53-44(74)46(43(73)47(86-53)48(75)76)85-51-40(70)36(66)33(63)24(2)80-51/h10,23-24,26-47,49-53,61-74H,11-22H2,1-9H3,(H,75,76)/t23-,24+,26+,27-,28-,29+,30-,31+,32-,33+,34-,35+,36-,37+,38-,39+,40-,41-,42-,43+,44-,45-,46+,47+,49-,50-,51+,52+,53-,57+,58-,59-,60+/m1/s1 |
InChIKey | QFJJUJQDKVYMLM-KGBXKRPPSA-N |
Literature Reference Author | V.MSHVILDADZE,R.ELIAS,R.FAURE,L.DEBRAUWER,G.DEKANOSIDZE,E.KE MERTELIDZE,G.BALANSA |
Literature Reference Citation | CHEM.PHARM.BULL.,49,752(2001) |
Literature Reference DOI | 10.1248/cpb.49.752 |
Molecular Weight | 1249.406 g/mol |
Solvent | CD3OD |
Source File Reference | UWLU31732 |