AC1L6LZ5 structure

AC1L6LZ5

1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-trityloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

Also Known As: KST-1A3290|(3|A,5|A)-3-(trityloxy)pregnan-20-one|1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-trityloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

CAS: 26430-97-7
Molecular Formula C40H48O2
Molecular Weight 560.3654 g/mol
LogP 10.1
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 6
Exact Mass 560.3654
Monoisotopic Mass 560.3654
Heavy Atoms 42
Complexity 892.0

Chemical Identifiers

CAS Number 26430-97-7
SMILES CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)OC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C)C
InChIKey UFWXXVKAUNESJR-SPBFKUGRSA-N

Product Overview

AC1L6LZ5 (CAS 26430-97-7), with molecular formula C40H48O2 and molecular weight 560.3654 g/mol. IUPAC: 1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-trityloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone.

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