![NOTOGINSENOSIDE-H;6-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-20-O-(BETA-D-GLUCOPYRANOSYL)-3-BETA,6-ALPHA,12-BETA,20(S),25-PENTAHYDROXY](/api/spectrum/IL7qVCW3bBR/structure.png?h=300&w=458 "NOTOGINSENOSIDE-H;6-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-20-O-(BETA-D-GLUCOPYRANOSYL)-3-BETA,6-ALPHA,12-BETA,20(S),25-PENTAHYDROXY")
| SpectraBase Compound ID | 3rP1XfssmmA |
|---|---|
| InChI | InChI=1S/C47H80O19/c1-42(2,60)12-9-13-47(8,66-40-36(59)33(56)31(54)25(18-48)63-40)21-10-15-45(6)29(21)22(50)16-27-44(5)14-11-28(52)43(3,4)38(44)24(17-46(27,45)7)62-41-37(34(57)32(55)26(19-49)64-41)65-39-35(58)30(53)23(51)20-61-39/h9,12,21-41,48-60H,10-11,13-20H2,1-8H3/b12-9+/t21-,22+,23-,24-,25+,26-,27+,28-,29-,30+,31+,32-,33-,34+,35-,36+,37-,38-,39+,40-,41-,44+,45+,46+,47-/m0/s1 |
| InChIKey | BIRZHRCAUBJIEK-KQFUQWQNSA-N |
| Mol Weight | 949.1 g/mol |
| Molecular Formula | C47H80O19 |
| Exact Mass | 948.52938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IL7qVCW3bBR |
|---|---|
| Name | NOTOGINSENOSIDE-H;6-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-20-O-(BETA-D-GLUCOPYRANOSYL)-3-BETA,6-ALPHA,12-BETA,20(S),25-PENTAHYDROXY |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H80O19 |
| InChI | InChI=1S/C47H80O19/c1-42(2,60)12-9-13-47(8,66-40-36(59)33(56)31(54)25(18-48)63-40)21-10-15-45(6)29(21)22(50)16-27-44(5)14-11-28(52)43(3,4)38(44)24(17-46(27,45)7)62-41-37(34(57)32(55)26(19-49)64-41)65-39-35(58)30(53)23(51)20-61-39/h9,12,21-41,48-60H,10-11,13-20H2,1-8H3/b12-9+/t21-,22+,23-,24-,25+,26-,27+,28-,29-,30+,31+,32-,33-,34+,35-,36+,37-,38-,39+,40-,41-,44+,45+,46+,47-/m0/s1 |
| InChIKey | BIRZHRCAUBJIEK-KQFUQWQNSA-N |
| Literature Reference Author | M.YOSHIKAWA,T.MURAKAMI,T.UENO,N.HIROKAWA,K.YASHIRO,N.MURAKAM I,J.YAMAHARA,H.MATSU |
| Literature Reference Citation | CHEM.PHARM.BULL.,45,1056(1997) |
| Literature Reference DOI | 10.1248/cpb.45.1056 |
| Molecular Weight | 949.141 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN28904 |