| SpectraBase Spectrum ID |
J0FP0s7cLgf |
| Name |
16,17-Secoyohimban-17,17,21,21-D4-16,17-diol, diacetate (ester), (3.beta.)-(.+-.)- |
| CAS Registry Number |
88939-29-1 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H26D4N2O4 |
| InChI |
InChI=1S/C23H30N2O4/c1-15(26)28-11-5-6-17-13-25-10-9-20-19-7-3-4-8-21(19)24-23(20)22(25)12-18(17)14-29-16(2)27/h3-4,7-8,17-18,22,24H,5-6,9-14H2,1-2H3/t17-,18-,22-/m1/s1/i11D2,13D2 |
| InChIKey |
HWIGWXYADAUGKJ-FGPDWYLKSA-N |
| Molecular Weight |
402.527 g/mol |
| SMILES |
[nH]1c2ccccc2c2c1[C@@]1(N(CC2)C([C@]([C@](C1)(COC(=O)C)[H])(CCC(OC(=O)C)([2D])[2D])[H])([2D])[2D])[H] |
| SPLASH |
splash10-0udi-0203900000-6977d7cce722bb39357b |
| Source of Spectrum |
F-39-3671-0 |
| Synonyms |
Indoloquinolizidine
Indolo[2,3-a]quinolizine, 16,17-secoyohimban-17,17,21,21-D4-16,17-diol deriv. |
| Wiley ID |
120726 |
![16,17-Secoyohimban-17,17,21,21-D4-16,17-diol, 18-[(acetyloxy)methyl-D2]-, diacetate (ester), (3.beta.)-(.+-.)-](/api/spectrum/J0FP0s7cLgf/structure.png?h=300&w=458 "16,17-Secoyohimban-17,17,21,21-D4-16,17-diol, 18-[(acetyloxy)methyl-D2]-, diacetate (ester), (3.beta.)-(.+-.)-")
