| SpectraBase Compound ID | 3gKXj3mPp7e |
|---|---|
| InChI | InChI=1S/C53H84O24/c1-48(2)15-22-21-14-23(57)42-50(4)10-9-28(51(5,20-56)27(50)8-11-53(42,7)52(21,6)13-12-49(22,3)29(16-48)74-44-37(66)30(59)24(58)19-70-44)73-47-41(36(65)35(64)39(75-47)43(68)69)77-46-40(34(63)32(61)26(18-55)72-46)76-45-38(67)33(62)31(60)25(17-54)71-45/h14,22,24-42,44-47,54-56,58-67H,8-13,15-20H2,1-7H3,(H,68,69)/t22-,24-,25+,26+,27+,28-,29+,30+,31+,32-,33-,34-,35-,36-,37-,38+,39-,40+,41+,42+,44+,45-,46+,47+,49+,50-,51+,52+,53+/m0/s1 |
| InChIKey | NZGWNOOSBMQEEK-MGOVBUENSA-N |
| Mol Weight | 1105.2 g/mol |
| Molecular Formula | C53H84O24 |
| Exact Mass | 1104.535254 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7lGNkfTQbSH |
|---|---|
| Name | 3-O-BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-COMPLOGENIN-22-O-BETA-D-XYLOPYRANOSIDE |
| Compound Number | GM-11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H84O24 |
| InChI | InChI=1S/C53H84O24/c1-48(2)15-22-21-14-23(57)42-50(4)10-9-28(51(5,20-56)27(50)8-11-53(42,7)52(21,6)13-12-49(22,3)29(16-48)74-44-37(66)30(59)24(58)19-70-44)73-47-41(36(65)35(64)39(75-47)43(68)69)77-46-40(34(63)32(61)26(18-55)72-46)76-45-38(67)33(62)31(60)25(17-54)71-45/h14,22,24-42,44-47,54-56,58-67H,8-13,15-20H2,1-7H3,(H,68,69)/t22-,24-,25+,26+,27+,28-,29+,30+,31+,32-,33-,34-,35-,36-,37-,38+,39-,40+,41+,42+,44+,45-,46+,47+,49+,50-,51+,52+,53+/m0/s1 |
| InChIKey | NZGWNOOSBMQEEK-MGOVBUENSA-N |
| Literature Reference Author | Y.TSUNODA,M.OKAWA,J.KINJO,T.IKEDA,T.NOHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,1138(2008) |
| Literature Reference DOI | 10.1248/cpb.56.1138 |
| Molecular Weight | 1105.236 g/mol |
| Sample ID | 2051 |
| Solvent | C5D5N |