| SpectraBase Spectrum ID |
6nkuOJlWpAe |
| Name |
clavinflol B monoacetate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H35ClO5 |
| InChI |
InChI=1S/C22H35ClO5/c1-14-6-7-17(23)21(26,13-27-15(2)24)12-18-22(28-18)16(19(3,4)25)9-11-20(22,5)10-8-14/h16-18,25-26H,1,6-13H2,2-5H3/t16-,17-,18-,20+,21-,22-/m0/s1 |
| InChIKey |
MHVLIPPDAODSCC-WTNOFXFJSA-N |
| Literature Reference DOI |
10.1002/jccs.200300074 |
| Molecular Weight |
414.970 g/mol |
| SMILES |
OC([C@]1([C@]23[C@](CCC(CC[C@@]([C@@](C[C@@]3(O2)[H])(O)COC(C)=O)(Cl)[H])=C)(CC1)C)[H])(C)C |
| SPLASH |
splash10-052f-9000000000-37dc6284c1dc4fb58f20 |
| Source of Spectrum |
QA-50-475-7 |
| Synonyms |
((1aS,3S,4S,9aS,12S,12aR)-4-chloro-3-hydroxy-12-(2-hydroxypropan-2-yl)-9a-methyl-7-methylenedodecahydro-3H-cyclopenta[1,11]cycloundeca[1,2-b]oxiren-3-yl)methyl acetate
((1aR,2S,4aS,10S,11S,12aS)-10-chloro-11-hydroxy-2-(2-hydroxypropan-2-yl)-4a-methyl-7-methylenedodecahydro-2H-cyclopenta[1,11]cycloundeca[1,2-b]oxiren-11-yl)methyl acetate |
| Wiley ID |
1795777 |
