3a,10a-Dihydroxy-5-(hydroxymethyl)-2,10-dimethyl-3-oxo-3,3a,4,6a,7,8,9,10,10a,10b-decahydrobenzo[e]azulen-8-yl myristate

SpectraBase Compound ID	W8tbgW4Ewu
InChI	InChI=1S/C31H50O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-28(33)37-26-17-23(3)31(36)25(19-26)18-24(21-32)20-30(35)27(31)16-22(2)29(30)34/h16,18,23,25-27,32,35-36H,4-15,17,19-21H2,1-3H3
InChIKey	GHGDIFRPPASMHD-UHFFFAOYSA-N Google Search
Mol Weight	518.7 g/mol
Molecular Formula	C31H50O6
Exact Mass	518.360739 g/mol

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SpectraBase Spectrum ID	30Krdy9RXjB
Name	3a,10a-Dihydroxy-5-(hydroxymethyl)-2,10-dimethyl-3-oxo-3,3a,4,6a,7,8,9,10,10a,10b-decahydrobenzo[e]azulen-8-yl myristate
Alternate Name(s)	myristic acid (3a,10a-dihydroxy-3-keto-2,10-dimethyl-5-methylol-6a,7,8,9,10,10b-hexahydro-4H-benz[e]azulen-8-yl) ester Tetradecanoic acid, 3,3a,4,6a,7,8,9,10,10a,10b-decahydro-3a,10a-dihydroxy-5-(hydroxymethyl)-2,10-dimethyl-3-oxobenz[e]azulen-8-yl ester, [3aR-(3a.alpha.,6a.alpha.,8.alpha.,10.beta.,10a.beta.,10b.beta.)]- Tetradecanoic acid [3a,10a-dihydroxy-5-(hydroxymethyl)-2,10-dimethyl-3-oxo-6a,7,8,9,10,10b-hexahydro-4H-benzo[e]azulen-8-yl] ester [3a,10a-dihydroxy-5-(hydroxymethyl)-2,10-dimethyl-3-oxo-6a,7,8,9,10,10b-hexahydro-4H-benzo[e]azulen-8-yl] tetradecanoate
CAS Registry Number	77058-95-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C31H50O6
InChI	InChI=1S/C31H50O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-28(33)37-26-17-23(3)31(36)25(19-26)18-24(21-32)20-30(35)27(31)16-22(2)29(30)34/h16,18,23,25-27,32,35-36H,4-15,17,19-21H2,1-3H3
InChIKey	GHGDIFRPPASMHD-UHFFFAOYSA-N
Molecular Weight	518.735 g/mol
SMILES	OC12CC(CO)=CC3CC(CC(C3(C1C=C(C2=O)C)O)C)OC(=O)CCCCCCCCCCCCC
SPLASH	splash10-0abc-5950000000-8578d11b5b2e54b61f08
Source of Spectrum	W5-0-0-0
Wiley ID	1401753