SpectraBase Spectrum ID |
CDSSCpJx8jp |
Name |
.delta.3,.delta.5-2-Tryptophyl-4-carbo-tert-butoxy-5-carbomethoxy-7-[1,1-(ethylenedioxy)-ethyl]hexahydroisoquinoline |
CAS Registry Number |
87371-70-8 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H38N2O6 |
InChI |
InChI=1S/C30H38N2O6/c1-29(2,3)38-28(34)24-18-32(11-10-19-16-31-25-9-7-6-8-22(19)25)17-20-14-21(30(4)36-12-13-37-30)15-23(26(20)24)27(33)35-5/h6-9,15-16,18,20-21,26,31H,10-14,17H2,1-5H3 |
InChIKey |
WMAVEXCWAYJELO-UHFFFAOYSA-N |
Molecular Weight |
522.642 g/mol |
SMILES |
[nH]1c2c(c(c1)CCN1C=C(C3C(=CC(C4(OCCO4)C)CC3C1)C(=O)OC)C(OC(C)(C)C)=O)cccc2 |
SPLASH |
splash10-000i-9100100000-8546c2d55a8c402c1552 |
Source of Spectrum |
J-48-4265-0 |
Synonyms |
4-tert-Butyl 5-methyl 2-[2-(1H-indol-3-yl)ethyl]-7-(2-methyl-1,3-dioxolan-2-yl)-1,2,4a,7,8,8a-hexahydro-4,5-isoquinolinedicarboxylate |
Wiley ID |
1402288 |