| SpectraBase Spectrum ID |
LWUiWiDyJI4 |
| Name |
Yuanhuadine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H42O10 |
| InChI |
InChI=1S/C32H42O10/c1-7-8-9-10-11-12-13-14-29-40-26-22-25-28(16-33,39-25)27(36)30(37)21(15-18(4)23(30)35)32(22,42-29)19(5)24(38-20(6)34)31(26,41-29)17(2)3/h11-15,19,21-22,24-27,33,36-37H,2,7-10,16H2,1,3-6H3/b12-11+,14-13+/t19-,21-,22+,24-,25+,26-,27-,28+,29-,30-,31+,32+/m1/s1 |
| InChIKey |
NHELFTYSELEEFD-SVAWBNMMSA-N |
| Molecular Weight |
586.678 g/mol |
| SMILES |
O[C@]12[C@@]([C@@]3(CO)O[C@]3([C@]3([C@]4(O[C@@]5(O[C@]4([C@@]([C@]([C@@]3([C@@]1(C=C(C2=O)C)[H])O5)(C)[H])(OC(C)=O)[H])C(C)=C)\C=C\C=C\CCCCC)[H])[H])[H])(O)[H] |
| SPLASH |
splash10-0udi-0932010000-8ae18de36e0957c9221c |
| Source of Spectrum |
SI-3-219-8 |
| Synonyms |
(2S,3aR,3bS,3cS,4aR,5S,5aS,8aR,8bR,9R,10R,10aS)-5,5a-dihydroxy-4a-(hydroxymethyl)-7,9-dimethyl-2-((1E,3E)-nona-1,3-dien-1-yl)-6-oxo-10a-(prop-1-en-2-yl)-3a,3b,3c,4a,5,5a,8a,9,10,10a-decahydro-6H-2,8b-epoxyoxireno[2'',3'':6',7']azuleno[5',4':3,4]benzo[1,2-d][1,3]dioxol-10-yl acetate |
| Wiley ID |
1813319 |
