| SpectraBase Spectrum ID |
3QBY9bWErML |
| Name |
1,6,15-triacetoxy-2,9-dibenzoyloxy-dihydroagarofurane |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H40O11 |
| InChI |
InChI=1S/C35H40O11/c1-20-17-27(44-31(39)24-13-9-7-10-14-24)30(43-23(4)38)34(19-41-21(2)36)28(45-32(40)25-15-11-8-12-16-25)18-26-29(42-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20?,26-,27+,28-,29?,30+,34-,35-/m1/s1 |
| InChIKey |
NDGSLRUFUIEVLM-OSVHJVQZSA-N |
| Molecular Weight |
636.694 g/mol |
| SMILES |
[C@@]12([C@]3(C(OC(=O)C)[C@@](C[C@]2(OC(=O)c2ccccc2)[H])(C(O3)(C)C)[H])C(C)C[C@@]([C@@]1(OC(=O)C)[H])(OC(=O)c1ccccc1)[H])COC(=O)C |
| SPLASH |
splash10-0zfr-0848590000-d313bc57af791a9312a9 |
| Source of Spectrum |
KC-1989-1094-37 |
| Synonyms |
(1S,4S,5R,6R,7R,9R)-5,12-bis(acetyloxy)-6-[(acetyloxy)methyl]-4-(benzoyloxy)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0(1,6)]dodec-7-yl benzoate |
| Wiley ID |
1412391 |
