| SpectraBase Spectrum ID |
gWPjNyhWfP |
| Name |
3H-Benz[e]indole-3-carboxylic acid, 1-[[[(acetyloxy)phenylacetyl]oxy]methyl]-1,2-dihydro-5-(phenylmethoxy)-, 1,1-dimethylethyl ester, [R-(R*,R*)]- |
| CAS Registry Number |
128228-77-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H35NO7 |
| InChI |
InChI=1S/C35H35NO7/c1-23(37)42-32(25-15-9-6-10-16-25)33(38)41-22-26-20-36(34(39)43-35(2,3)4)29-19-30(40-21-24-13-7-5-8-14-24)27-17-11-12-18-28(27)31(26)29/h5-19,26,32H,20-22H2,1-4H3/t26-,32-/m1/s1 |
| InChIKey |
RXBOMYABMHHBFX-HVIPQOSHSA-N |
| Molecular Weight |
581.665 g/mol |
| SMILES |
c12N(C[C@@](c2c2ccccc2c(c1)OCc1ccccc1)(COC([C@](OC(=O)C)(c1ccccc1)[H])=O)[H])C(OC(C)(C)C)=O |
| SPLASH |
splash10-00r6-9057050000-9b5dfba35c1710f1ebe9 |
| Source of Spectrum |
J-55-5830-31 |
| Synonyms |
(1R,2R')-5-(benzyloxy)-3-(t-butyloxycarbonyl)-1-hydroxymethyl-1,2-dihydro-3H-benz[e]indole, (R)-(-)-O-acetyl mandelate ester
tert-Butyl (1R)-1-({[(2R)-2-(acetyloxy)-2-phenylethanoyl]oxy}methyl)-5-(benzyloxy)-1,2-dihydro-3H-benzo[e]indole-3-carboxylate |
| Wiley ID |
1408592 |
![3H-Benz[e]indole-3-carboxylic acid, 1-[[[(acetyloxy)phenylacetyl]oxy]methyl]-1,2-dihydro-5-(phenylmethoxy)-, 1,1-dimethylethyl ester, [R-(R*,R*)]-](/api/spectrum/gWPjNyhWfP/structure.png?h=300&w=458 "3H-Benz[e]indole-3-carboxylic acid, 1-[[[(acetyloxy)phenylacetyl]oxy]methyl]-1,2-dihydro-5-(phenylmethoxy)-, 1,1-dimethylethyl ester, [R-(R*,R*)]-")
