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(7R,12R,13R)-15-(2'-Acetoxyethylidene)-N(4),12,13-trimethyl-8,11,16-trioxo-4-aza-10,17-dioxabicyclo[9.5.1]heptadec-1-ene-12-ol

View entire compound with spectra: 1 MS (GC)

(7R,12R,13R)-15-(2'-Acetoxyethylidene)-N(4),12,13-trimethyl-8,11,16-trioxo-4-aza-10,17-dioxabicyclo[9.5.1]heptadec-1-ene-12-ol
SpectraBase Compound ID 8gVp5nXwMQZ
InChI InChI=1S/C21H29NO8/c1-13-11-15(7-10-28-14(2)23)19(25)30-17-6-9-22(4)8-5-16(18(17)24)12-29-20(26)21(13,3)27/h5,7,13,17,27H,6,8-12H2,1-4H3/b15-7-,16-5-/t13-,17-,21-/m1/s1
InChIKey VSDQPXFTDJVJID-GCNIUZCMSA-N
Mol Weight 423.46 g/mol
Molecular Formula C21H29NO8
Exact Mass 423.189317 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tAy8V6TnvZ
Name (7R,12R,13R)-15-(2'-Acetoxyethylidene)-N(4),12,13-trimethyl-8,11,16-trioxo-4-aza-10,17-dioxabicyclo[9.5.1]heptadec-1-ene-12-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO8
InChI InChI=1S/C21H29NO8/c1-13-11-15(7-10-28-14(2)23)19(25)30-17-6-9-22(4)8-5-16(18(17)24)12-29-20(26)21(13,3)27/h5,7,13,17,27H,6,8-12H2,1-4H3/b15-7-,16-5-/t13-,17-,21-/m1/s1
InChIKey VSDQPXFTDJVJID-GCNIUZCMSA-N
Molecular Weight 423.462 g/mol
SMILES O[C@@]1([C@@](C\C(C(O[C@]2(C(\C(=C/CN(CC2)C)COC1=O)=O)[H])=O)=C\COC(=O)C)(C)[H])C
SPLASH splash10-00r2-0931000000-20f789614d933c903aed
Source of Spectrum X2-54-1426-1
Synonyms (2Z)-2-[(1R,6R,7R)-7-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-4-ylidene]ethyl acetate 15-(2'-Acetoxyethylidene)-N(4),12,13-trimethyl-8,11,16-trioxo-4-aza-10,17-dioxabicyclo[9.5.1]heptadec-1-ene Acetyl-anonamine
Wiley ID 1604244