SpectraBase Spectrum ID |
EQM5NUvvCLW |
Name |
Methyl 12(r,s)-12-acetoxy-8-hydroxy-labdan-15-oate |
CAS Registry Number |
108888-76-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H40O5 |
InChI |
InChI=1S/C23H40O5/c1-15(13-20(25)27-7)17(28-16(2)24)14-19-22(5)11-8-10-21(3,4)18(22)9-12-23(19,6)26/h15,17-19,26H,8-14H2,1-7H3/t15-,17?,18?,19?,22-,23+/m0/s1 |
InChIKey |
WOYIYWIFNCPUMZ-MBMXOHCNSA-N |
Molecular Weight |
396.568 g/mol |
SMILES |
O[C@]1(C([C@@]2(C(C(C)(C)CCC2)CC1)C)CC(OC(=O)C)[C@](CC(=O)OC)(C)[H])C |
SPLASH |
splash10-06ds-7902000000-6d8db4ad295503f382ae |
Source of Spectrum |
F-42-4572-11 |
Synonyms |
Methyl (3S)-4-(acetyloxy)-5-[(2R,8aS)-2-hydroxy-2,5,5,8a-tetramethyldecahydro-1-naphthalenyl]-3-methylpentanoate |
Wiley ID |
1367574 |