SpectraBase Spectrum ID |
61MfENKrcTK |
Name |
(22Z)-24,24-dimethyl-5.alpha.-cholesta-7,22-dien-3.beta.-ol acetate |
CAS Registry Number |
118112-72-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C31H50O2 |
InChI |
InChI=1S/C31H50O2/c1-20(2)29(5,6)16-13-21(3)26-11-12-27-25-10-9-23-19-24(33-22(4)32)14-17-30(23,7)28(25)15-18-31(26,27)8/h10,13,16,20-21,23-24,26-28H,9,11-12,14-15,17-19H2,1-8H3/b16-13-/t21-,23+,24+,26-,27+,28+,30+,31-/m1/s1 |
InChIKey |
YCCBPMSLHPYQDN-SECDTYSJSA-N |
Molecular Weight |
454.739 g/mol |
SMILES |
C=12[C@]3([C@]([C@@]([C@@](\C=C/C(C(C)C)(C)C)(C)[H])(CC3)[H])(C)CC[C@@]2([C@]2(CC[C@](OC(=O)C)(C[C@@]2(CC1)[H])[H])C)[H])[H] |
SPLASH |
splash10-08gi-5096600000-bc26770f61260fb0abbc |
Source of Spectrum |
J-54-610-7 |
Synonyms |
(1R,2S,5S,7S,11R,14R,15R)-2,15-dimethyl-14-[(2R,3Z)-5,5,6-trimethylhept-3-en-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-9-en-5-yl acetate |
Wiley ID |
1388947 |