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Glycine, N-[(17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,12,13,18-heptamethyl-1, 19-dioxo-21H-bilin-3-yl)acetyl]-, (.+-.)-
SpectraBase Compound ID UHPYUQACpV
InChI InChI=1S/C32H39N5O5/c1-9-20-19(6)30(41)36-25(20)11-23-17(4)15(2)21(34-23)10-22-16(3)18(5)24(35-22)12-26-29(32(7,8)31(42)37-26)27(38)13-33-14-28(39)40/h10-12,29,33-34H,9,13-14H2,1-8H3,(H,36,41)(H,37,42)(H,39,40)/b22-10-,25-11-,26-12-
InChIKey SJKSHSZBTQIKSH-DNDCKGEJSA-N
Mol Weight 573.7 g/mol
Molecular Formula C32H39N5O5
Exact Mass 573.295119 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhX6WnykrPI
Name Glycine, N-[(17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,12,13,18-heptamethyl-1, 19-dioxo-21H-bilin-3-yl)acetyl]-, (.+-.)-
CAS Registry Number 93827-41-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H39N5O5
InChI InChI=1S/C32H39N5O5/c1-9-20-19(6)30(41)36-25(20)11-23-17(4)15(2)21(34-23)10-22-16(3)18(5)24(35-22)12-26-29(32(7,8)31(42)37-26)27(38)13-33-14-28(39)40/h10-12,29,33-34H,9,13-14H2,1-8H3,(H,36,41)(H,37,42)(H,39,40)/b22-10-,25-11-,26-12-
InChIKey SJKSHSZBTQIKSH-DNDCKGEJSA-N
Molecular Weight 573.694 g/mol
SMILES N1C(C(C(C(CNCC(=O)O)=O)\C1=C/C1=N\C(=C/c2[nH]c(c(c2C)C)\C=C/2NC(C(=C2CC)C)=O)C(=C1C)C)(C)C)=O
SPLASH splash10-056s-9200000000-131184340771168f35a4
Source of Spectrum AH-115-1078-0
Synonyms 21H-Biline, glycine deriv. Amide of rac-(4Z,9Z,15Z)-17-ethyl-1,19-dioxo-2,2,7,8,12,13,18-heptamethyl-1,2,3,19,23,24-hexahydro-21H-bilin-3-N-glycyl-acetic acid {[2-((2Z)-2-{[(2Z)-2-({5-[(Z)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-3,4-dimethyl-1H-pyrrol-2-yl}methylene)-3,4-dimethyl-2H-pyrrol-5-yl]methylene}-4,4-dimethyl-5-oxopyrrolidinyl)-2-oxoethyl]amino}acetic acid
Wiley ID 1407952