For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Deoxyharringtonine
SpectraBase Compound ID 3AECZcQwVBU
InChI InChI=1S/C28H37NO8/c1-17(2)6-9-28(32,15-23(30)34-4)26(31)37-25-22(33-3)14-27-8-5-10-29(27)11-7-18-12-20-21(36-16-35-20)13-19(18)24(25)27/h12-14,17,24-25,32H,5-11,15-16H2,1-4H3
InChIKey WRCBXHDQHPUVHW-UHFFFAOYSA-N
Mol Weight 515.6 g/mol
Molecular Formula C28H37NO8
Exact Mass 515.251917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GzVMNhcJ7hO
Name Deoxyharringtonine
CAS Registry Number 36804-95-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H37NO8
InChI InChI=1S/C28H37NO8/c1-17(2)6-9-28(32,15-23(30)34-4)26(31)37-25-22(33-3)14-27-8-5-10-29(27)11-7-18-12-20-21(36-16-35-20)13-19(18)24(25)27/h12-14,17,24-25,32H,5-11,15-16H2,1-4H3
InChIKey WRCBXHDQHPUVHW-UHFFFAOYSA-N
Molecular Weight 515.603 g/mol
SMILES OC(C(OC1C2C3(CCCN3CCc3c2cc2OCOc2c3)C=C1OC)=O)(CC(OC)=O)CCC(C)C
SPLASH splash10-0002-3290020000-ee06efea43cb960afb36
Source of Spectrum CD-172-0-0
Synonyms 3(R)-Deoxyharringtonine 4H-Cyclopenta[a][1,3]dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepine, cephalotaxine deriv. Cephalotaxine, 4-methyl-, 2-hydroxy-2-(3-methylbutyl)butanedioate (ester), (3(R))- Desoxyharringtonin Harringtonine, deoxy- NSC 142196
Wiley ID 1401295