Ergosta-4,6,8(14),22-tetraen-3-one

Datasheet MSDS
Catalog Number
ANC06335
Product Name
Ergosta-4,6,8(14),22-tetraen-3-one
Structure
Ergosta-4,6,8(14),22-tetraen-3-one
CAS Number
19254-69-4
IUPAC Name
(9R,10R,13R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,9,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one
Synonyms
Ergone
Molecular Formula
C28H40O
Molecular Weight
392.6
Appearance
Powder
Purity
>98%
SMILES
C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CCC2=C3C=CC4=CC(=O)CC[C@@]4([C@H]3CC[C@]12C)C
InChI
InChI=1S/C28H40O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,17-20,24,26H,11-16H2,1-6H3/b8-7+/t19-,20+,24+,26-,27-,28+/m0/s1
InChI Key
OIMXTYUHMBQQJM-HSVWHVBGSA-N
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