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Cephalotaxine, 4-methyl 2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate (ester), [3(R)]-
SpectraBase Compound ID 68kIq5aNagr
InChI InChI=1S/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3
InChIKey HAVJATCHLFRDHY-UHFFFAOYSA-N
Mol Weight 531.6 g/mol
Molecular Formula C28H37NO9
Exact Mass 531.246832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FkapjjhgLmo
Name Cephalotaxine, 4-methyl 2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate (ester), [3(R)]-
CAS Registry Number 26833-85-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H37NO9
InChI InChI=1S/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3
InChIKey HAVJATCHLFRDHY-UHFFFAOYSA-N
Molecular Weight 531.602 g/mol
SMILES OC(CCC(C(OC1C2C3(N(CCc4c2cc2OCOc2c4)CCC3)C=C1OC)=O)(CC(OC)=O)O)(C)C
SPLASH splash10-0002-2490030000-b3dd4296748f0741e05a
Source of Spectrum CD-174-0-0
Synonyms 2'R-Harringtonine 4H-Cyclopenta[a][1,3]dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepine, cephalotaxine deriv. Alkaloid C from Cephalotaxus Cephalotaxine, 4-methyl (2R)-2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate (ester) Cephalotaxine, 4-methyl 2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate (ester) Harringtonin Harringtonine NSC 124147
Wiley ID 1403468