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Methyl (1S,4aR,5S,8aR)-5-(2-{2-[2-(1Z)-1-amino-3-ethoxy-3-oxoprop-1-en-1-yl]-3-furyl}ethyl)-1,4adimethyl-6-methylenedecahydronaphthalene-1-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl (1S,4aR,5S,8aR)-5-(2-{2-[2-(1Z)-1-amino-3-ethoxy-3-oxoprop-1-en-1-yl]-3-furyl}ethyl)-1,4adimethyl-6-methylenedecahydronaphthalene-1-carboxylate
SpectraBase Compound ID Cal4XIMFmku
InChI InChI=1S/C26H37NO5/c1-6-31-22(28)16-20(27)23-18(12-15-32-23)9-10-19-17(2)8-11-21-25(19,3)13-7-14-26(21,4)24(29)30-5/h12,15-16,19,21H,2,6-11,13-14,27H2,1,3-5H3/b20-16-/t19-,21+,25+,26-/m0/s1
InChIKey KGCZOGQNPICQTB-XJWQAQJHSA-N
Mol Weight 443.6 g/mol
Molecular Formula C26H37NO5
Exact Mass 443.267173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4g5rnwn3d0w
Name Methyl (1S,4aR,5S,8aR)-5-(2-{2-[2-(1Z)-1-amino-3-ethoxy-3-oxoprop-1-en-1-yl]-3-furyl}ethyl)-1,4adimethyl-6-methylenedecahydronaphthalene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37NO5
InChI InChI=1S/C26H37NO5/c1-6-31-22(28)16-20(27)23-18(12-15-32-23)9-10-19-17(2)8-11-21-25(19,3)13-7-14-26(21,4)24(29)30-5/h12,15-16,19,21H,2,6-11,13-14,27H2,1,3-5H3/b20-16-/t19-,21+,25+,26-/m0/s1
InChIKey KGCZOGQNPICQTB-XJWQAQJHSA-N
Molecular Weight 443.584 g/mol
SMILES N\C(=C/C(=O)OCC)c1c(CC[C@@]2([C@@]3([C@]([C@](C(=O)OC)(C)CCC3)(CCC2=C)[H])C)[H])cco1
SPLASH splash10-006w-0972700000-bfbbfefac5288ced6ecc
Source of Spectrum O1-46-1343-3
Wiley ID 1669399