| SpectraBase Compound ID | 9dS8jq1Fuim |
|---|---|
| InChI | InChI=1S/C52H82O22/c1-22(20-66-47-42(62)41(61)39(59)34(19-53)70-47)12-15-52(64-9)23(2)37-33(74-52)18-32-30-11-10-28-16-29(57)17-36(51(28,8)31(30)13-14-50(32,37)7)72-49-46(73-48-43(63)40(60)38(58)24(3)67-48)45(69-27(6)56)44(68-26(5)55)35(71-49)21-65-25(4)54/h10,22-24,29-49,53,57-63H,11-21H2,1-9H3/t22-,23+,24-,29-,30-,31+,32+,33+,34+,35+,36-,37+,38-,39+,40+,41-,42+,43+,44-,45-,46+,47+,48-,49-,50?,51?,52?/m1/s1 |
| InChIKey | SRTSUTLVZINNEZ-RYOKDAEWSA-N |
| Mol Weight | 1059.2 g/mol |
| Molecular Formula | C52H82O22 |
| Exact Mass | 1058.529774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C2yEGKhNdh0 |
|---|---|
| Name | #41;26-O-BETA-D-GLUCOPYRANOSYL-22-XI-METHOXY-1-BETA,3-BETA,26-TRIHYDROXY-(25R)-FUROST-5-ENE-1-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-3,4,6-TRI-O-ACETY-BETA-D-GALACTO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H82O22 |
| InChI | InChI=1S/C52H82O22/c1-22(20-66-47-42(62)41(61)39(59)34(19-53)70-47)12-15-52(64-9)23(2)37-33(74-52)18-32-30-11-10-28-16-29(57)17-36(51(28,8)31(30)13-14-50(32,37)7)72-49-46(73-48-43(63)40(60)38(58)24(3)67-48)45(69-27(6)56)44(68-26(5)55)35(71-49)21-65-25(4)54/h10,22-24,29-49,53,57-63H,11-21H2,1-9H3/t22-,23+,24-,29-,30-,31+,32+,33+,34+,35+,36-,37+,38-,39+,40+,41-,42+,43+,44-,45-,46+,47+,48-,49-,50?,51?,52?/m1/s1 |
| InChIKey | SRTSUTLVZINNEZ-RYOKDAEWSA-N |
| Literature Reference Author | P.K.AGRAWAL |
| Literature Reference Citation | STEROIDS,70,715(2005) |
| Literature Reference DOI | 10.1016/j.steroids.2005.04.001 |
| Molecular Weight | 1059.210 g/mol |
| Sample ID | 968786 |
| Solvent | C5D5N |