SpectraBase Spectrum ID |
I7tPv9NSNTJ |
Name |
3a,6-Ethano-3aH-indene-4-propanoic acid, octahydro-7a-hydroxy-1,5,5-trimethyl-, [1S-(1.alpha.,3a.beta.,4.beta.,6.beta.,7a.alpha.)]- |
CAS Registry Number |
90836-08-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H28O3 |
InChI |
InChI=1S/C17H28O3/c1-11-6-8-16-9-7-12(10-17(11,16)20)15(2,3)13(16)4-5-14(18)19/h11-13,20H,4-10H2,1-3H3,(H,18,19)/t11-,12+,13-,16+,17-/m0/s1 |
InChIKey |
QFQIAOAXEHSEDC-DCRFOKDXSA-N |
Molecular Weight |
280.408 g/mol |
SMILES |
OC(CC[C@@]1([C@@]23[C@](C[C@](C1(C)C)(CC3)[H])([C@](CC2)(C)[H])O)[H])=O |
SPLASH |
splash10-053r-0910000000-82f52714c503fb8eb3ae |
Source of Spectrum |
B-37-789-0 |
Synonyms |
3-[(1S,4S,5S,7R,9S)-5-hydroxy-4,8,8-trimethyltricyclo[5.2.2.0(1,5)]undec-9-yl]propanoic acid
Monohydroxy-t-butyl ammonium salt of eremane hydroxy acid |
Wiley ID |
1284173 |