5-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-2,3,4-trihydroxybenzoic acid methyl ester

SpectraBase Compound ID	3Y5wkFXrl6H
InChI	InChI=1S/C23H32O5/c1-13-7-6-8-17-22(13,3)10-9-14(2)23(17,4)12-15-11-16(21(27)28-5)19(25)20(26)18(15)24/h11,14,17,24-26H,1,6-10,12H2,2-5H3/t14-,17+,22+,23+/m0/s1
InChIKey	MFMAXXNRMUAGPE-VITDHJIUSA-N Google Search
Mol Weight	388.5 g/mol
Molecular Formula	C23H32O5
Exact Mass	388.224974 g/mol

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SpectraBase Spectrum ID	L7IFKnU1dSG
Name	5-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-2,3,4-trihydroxybenzoic acid methyl ester
CAS Registry Number	104900-67-6
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H32O5
InChI	InChI=1S/C23H32O5/c1-13-7-6-8-17-22(13,3)10-9-14(2)23(17,4)12-15-11-16(21(27)28-5)19(25)20(26)18(15)24/h11,14,17,24-26H,1,6-10,12H2,2-5H3/t14-,17+,22+,23+/m0/s1
InChIKey	MFMAXXNRMUAGPE-VITDHJIUSA-N
Molecular Weight	388.504 g/mol
SMILES	Oc1c(c(cc(c1O)C[C@]1([C@]2([C@](C(=C)CCC2)(C)CC[C@@]1(C)[H])[H])C)C(=O)OC)O
SPLASH	splash10-0002-2900000000-e87c4f16c0484fa3ab23
Source of Spectrum	F-42-4200-4
Synonyms	5-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-2,3,4-trihydroxy-benzoic acid methyl ester Methyl 5-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-2,3,4-trihydroxy-benzoate Methyl 5-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-2,3,4-trihydroxybenzoate Methyl 5-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-2,3,4-tris(oxidanyl)benzoate
Wiley ID	1363962