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4a,18-dihydroxyclerodan-15-oic acid
SpectraBase Compound ID HmQ3n3zLI8
InChI InChI=1S/C20H36O4/c1-14(12-17(22)23)7-10-18(3)15(2)8-11-19(4)16(18)6-5-9-20(19,24)13-21/h14-16,21,24H,5-13H2,1-4H3,(H,22,23)/t14?,15-,16-,18+,19-,20+/m1/s1
InChIKey LVKUKTFPMNKMIN-RTCOZFHTSA-N
Mol Weight 340.5 g/mol
Molecular Formula C20H36O4
Exact Mass 340.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uMA3gFo9BX
Name 4a,18-dihydroxyclerodan-15-oic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36O4
InChI InChI=1S/C20H36O4/c1-14(12-17(22)23)7-10-18(3)15(2)8-11-19(4)16(18)6-5-9-20(19,24)13-21/h14-16,21,24H,5-13H2,1-4H3,(H,22,23)/t14?,15-,16-,18+,19-,20+/m1/s1
InChIKey LVKUKTFPMNKMIN-RTCOZFHTSA-N
Molecular Weight 340.504 g/mol
SMILES OC(CC(CC[C@@]1([C@@]2([C@]([C@@](CO)(CCC2)O)(CC[C@]1(C)[H])C)[H])C)C)=O
SPLASH splash10-0aos-9531000000-8b4f7f28eb909e7cd6a4
Source of Spectrum H-86-3192-7
Synonyms 5-Hydroxy-decahydro-5-(hydroxymethyl)-.beta.,1,2,4a-tetramethylnaphthalene-1-pentanoic Acid 5-[(1S,2R,4aR,5R,8aR)-5-hydroxy-5-(hydroxymethyl)-1,2,4a-trimethyldecahydro-1-naphthalenyl]-3-methylpentanoic acid
Wiley ID 1525667