| SpectraBase Spectrum ID |
YVjBo4Asu0 |
| Name |
Cycloart-23-ene-3.beta.,25-diol |
| Alternate Name(s) |
(1R,3aS,3bS,5aR,7S,9aR,10aS,12aR)-1-[(1R,3E)-5-hydroxy-1,5-dimethyl-3-hexenyl]-3a,6,6,12a-tetramethyltetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthren-7-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50O2 |
| InChI |
InChI=1S/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27-,28+,29-,30+/m1/s1 |
| InChIKey |
JSPGKOBNHWTKNT-CPGXJQKCSA-N |
| Molecular Weight |
442.728 g/mol |
| SMILES |
O[C@@]1(C([C@]2([C@@]3([C@@]4(CC[C@@]5([C@@]([C@@](C\C=C\C(O)(C)C)(C)[H])(CC[C@]5([C@@]4(CC2)[H])C)[H])C)C3)CC1)[H])(C)C)[H] |
| SPLASH |
splash10-0002-9000200000-9ff517b7aff5436b60a0 |
| Source of Spectrum |
QA-44-323-12 |
| Wiley ID |
862436 |
