| SpectraBase Spectrum ID |
6y9bYJgw07D |
| Name |
2-oct-1-en-3-Yloxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol, hexaacetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
674.278585385 u |
| Formula |
C31H46O16 |
| InChI |
InChI=1S/C31H46O16/c1-9-11-12-13-22(10-2)46-31-29(45-21(8)37)27(43-19(6)35)25(41-17(4)33)24(47-31)15-39-30-28(44-20(7)36)26(42-18(5)34)23(14-38-30)40-16(3)32/h10,22-31H,2,9,11-15H2,1,3-8H3 |
| InChIKey |
SAEXRUSJSOSSAE-UHFFFAOYSA-N |
| SMILES |
C1(OCC2C(C(C(C(OC(C=C)CCCCC)O2)OC(=O)C)OC(=O)C)OC(=O)C)OCC(C(C1OC(=O)C)OC(=O)C)OC(=O)C |
![2-oct-1-en-3-Yloxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol, hexaacetate](/api/spectrum/6y9bYJgw07D/structure.png?h=300&w=458 "2-oct-1-en-3-Yloxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol, hexaacetate")
