SpectraBase Spectrum ID |
A4Vg9y0g1aW |
Name |
Methyl 7.alpha.-acetoxy-18.beta.-hydroxy-11,17.alpha.-dimethoxy-7H-20.alpha.-yohimbane-16.beta.-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H32N2O7 |
InChI |
InChI=1S/C25H32N2O7/c1-13(28)34-25-7-8-27-12-14-9-20(29)22(32-3)21(24(30)33-4)16(14)11-19(27)23(25)26-18-10-15(31-2)5-6-17(18)25/h5-6,10,14,16,19-22,29H,7-9,11-12H2,1-4H3/t14-,16+,19+,20-,21+,22+,25+/m1/s1 |
InChIKey |
VSGDFDBMVIVAIG-AHPIHKQWSA-N |
Molecular Weight |
472.538 g/mol |
SMILES |
O[C@@]1(C[C@]2([C@@]([C@@]([C@]1(OC)[H])(C(=O)OC)[H])(C[C@]1(C=3[C@@](c4ccc(cc4N3)OC)(CCN1C2)OC(=O)C)[H])[H])[H])[H] |
SPLASH |
splash10-03di-0110900000-cd01becfd397db9c86f7 |
Source of Spectrum |
H-77-1344-20 |
Synonyms |
(7alpha,16beta,17alpha,18beta,20alpha)-18-hydroxy-11,17-dimethoxy-16-(methoxycarbonyl)-1,2-didehydro-2,7-dihydroyohimban-7-yl acetate |
Wiley ID |
1393328 |