| SpectraBase Compound ID | C8kedC6K89e |
|---|---|
| InChI | InChI=1S/C53H84O21/c1-10-24(3)38(57)47(64)70-35-22-67-50(46(45(35)69-27(6)55)73-49-44(63)41(60)39(58)26(5)68-49)72-36-18-29(56)17-28-11-12-30-31(52(28,36)8)14-15-51(7)32(30)19-33-37(51)25(4)53(65-9,74-33)16-13-23(2)21-66-48-43(62)42(61)40(59)34(20-54)71-48/h11,24-26,29-46,48-50,54,56-63H,2,10,12-22H2,1,3-9H3/t24-,25-,26+,29+,30+,31-,32-,33-,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-,44-,45+,46-,48-,49+,50+,51-,52-,53?/m0/s1 |
| InChIKey | VSWXIKJDYJMVEU-IVBFFCPDSA-N |
| Mol Weight | 1057.2 g/mol |
| Molecular Formula | C53H84O21 |
| Exact Mass | 1056.55051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bm55KZRjsIM |
|---|---|
| Name | #9;26-O-BETA-D-GLUCOPYRANOSYL-22-O-METHYL-FUROSTA-5,25(27)-DIENE-1-BETA,3-BETA,22-XI,26-TETROL-1-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-3-O-ACETYL-4-O-[(2S,3S)-2- |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H84O21 |
| InChI | InChI=1S/C53H84O21/c1-10-24(3)38(57)47(64)70-35-22-67-50(46(45(35)69-27(6)55)73-49-44(63)41(60)39(58)26(5)68-49)72-36-18-29(56)17-28-11-12-30-31(52(28,36)8)14-15-51(7)32(30)19-33-37(51)25(4)53(65-9,74-33)16-13-23(2)21-66-48-43(62)42(61)40(59)34(20-54)71-48/h11,24-26,29-46,48-50,54,56-63H,2,10,12-22H2,1,3-9H3/t24-,25-,26+,29+,30+,31-,32-,33-,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-,44-,45+,46-,48-,49+,50+,51-,52-,53?/m0/s1 |
| InChIKey | VSWXIKJDYJMVEU-IVBFFCPDSA-N |
| Literature Reference Author | Y.MIMAKI,M.KURODA,A.KAMEYAMA,A.YOKOSUKA,Y.SASHIDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,298(1998) |
| Literature Reference DOI | 10.1248/cpb.46.298 |
| Molecular Weight | 1057.237 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS6230 |