| SpectraBase Spectrum ID |
G57dEAsYrMY |
| Name |
8-Acetoxy-2,3-dihydroxy-13,14,15,16-tetrakis-nor-labd-12-oic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H30O6 |
| InChI |
InChI=1S/C18H30O6/c1-10(19)24-18(5)7-6-12-16(2,3)15(23)11(20)9-17(12,4)13(18)8-14(21)22/h11-13,15,20,23H,6-9H2,1-5H3,(H,21,22)/t11-,12?,13+,15-,17-,18+/m0/s1 |
| InChIKey |
MSCMUVUJSCRZPZ-GOJZZORYSA-N |
| Molecular Weight |
342.432 g/mol |
| SMILES |
O[C@@]1([C@@](C(C2[C@@]([C@@](CC(=O)O)([C@@](CC2)(OC(=O)C)C)[H])(C1)C)(C)C)(O)[H])[H] |
| SPLASH |
splash10-0006-9000000000-026f5021d4f5ac963a6b |
| Source of Spectrum |
SK-28-667-2 |
| Synonyms |
2-[(1R,2R,6R,7S,8aS)-2-acetyloxy-6,7-dihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]acetic acid
2-[(1R,2R,6R,7S,8aS)-2-acetyloxy-2,5,5,8a-tetramethyl-6,7-bis(oxidanyl)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethanoic acid |
| Wiley ID |
868193 |
