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PIMARATE,METHYLESTER

View entire compound with spectra: 2 NMR, and 15 MS (GC)

PIMARATE,METHYLESTER
SpectraBase Compound ID DusDKUPfFrh
InChI InChI=1S/C21H32O2/c1-6-19(2)13-10-16-15(14-19)8-9-17-20(16,3)11-7-12-21(17,4)18(22)23-5/h6,14,16-17H,1,7-13H2,2-5H3/t16-,17+,19+,20+,21+/m0/s1
InChIKey BGCXKCIPDDNDEV-MIGBRYPXSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7pdPQsYEAM0
Name 1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,10a.alpha.)]-
CAS Registry Number 3730-56-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-6-19(2)13-10-16-15(14-19)8-9-17-20(16,3)11-7-12-21(17,4)18(22)23-5/h6,14,16-17H,1,7-13H2,2-5H3/t16-,17+,19+,20+,21+/m0/s1
InChIKey BGCXKCIPDDNDEV-MIGBRYPXSA-N
Molecular Weight 316.485 g/mol
SMILES [C@@]12([C@]([C@](C(=O)OC)(CCC2)C)(CCC=2[C@@]1(CC[C@](C2)(C=C)C)[H])[H])C
SPLASH splash10-00di-3900000000-b4c2a547ee40a34f8b17
Source of Spectrum EP-0-321-0
Synonyms Methyl pimara-8(14),15-dien-18-oate 1,4a-dimethyl-7-vinyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-phenanthrene-1-carboxylic acid methyl ester 1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(1alpha,4abeta,4balpha,7beta,10aalpha)]- Dextropimaric acid methyl ester Methyl (1R-(1alpha,4abeta,4balpha,7beta,10aalpha))-7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-1-phenanthrenecarboxylate Methyl 13-vinylpodocarp-8(14)-en-15-oate Methyl 13.alpha.- methyl-13 vinyl-podocarp-8(14)-en-15 -oate Methyl 13.alpha.- methyl-13 vinyl-podocarp-8(14)-en-15 -oate[1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,10a.alpha.)]- 7 -ethenyl-1,2,3,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-1-phenanthrene-car boxylic acid, methyl ester Methyl 8(14),15-pimaradien-18-oate Methyl 8(14),15-pimaradien-18-oate (Zinkel) Methyl dextro-pimarate Methyl dextro-pimarate Mills cpd. XVIIa Methyl pimarate Pimarate Podocarp-8(14)-en-15-oic acid, 13.alpha.-methyl-13-vinyl-, methyl ester [1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,10a.alpha.)]- 7 -ethenyl-1,2,3,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-1-phenanthrene-carboxylic acid, methyl ester (CA)
Wiley ID 1317242