(22E)-26,27-Dinorergosta-1,4,22-trien-3-one
CAS Registry Number®
1262402-99-2
CAS Name
(22E)-26,27-Dinorergosta-1,4,22-trien-3-oneMolecular Formula
C26H38OMolecular Mass
366.58Cite this Page
(22E)-26,27-Dinorergosta-1,4,22-trien-3-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1262402-99-2 (retrieved ) (CAS RN: 1262402-99-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C26H38O/c1-17(2)6-7-18(3)22-10-11-23-21-9-8-19-16-20(27)12-14-25(19,4)24(21)13-15-26(22,23)5/h6-7,12,14,16-18,21-24H,8-11,13,15H2,1-5H3/b7-6+/t18-,21+,22-,23+,24+,25+,26-/m1/s1
InChIKey
InChIKey=JSHASXVESQAJJO-MZXJRKPGSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)C=C4)(CC1)[H])[H])(CC[C@@]2([C@@H](/C=C/C(C)C)C)[H])[H]
Canonical SMILES
O=C1C=CC2(C(=C1)CCC3C2CCC4(C)C(CCC34)C(C=CC(C)C)C)C
Other Names for this Substance
- 26,27-Dinorergosta-1,4,22-trien-3-one, (22E)-
- (22E)-26,27-Dinorergosta-1,4,22-trien-3-one