Cyclamiretin D

(2S,4aS,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5,10-dihydroxy-4a-(hydroxymethyl)-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carbaldehyde

Also Known As: Cyclamiretin D|3,16,28-Trihydroxyolean-12-en-29-al|3beta,16alpha,28-Trihydroxyolean-12-en-30-al|(20S)-3beta,16alpha,28-Trihydroxyolean-12-en-29-al|Olean-12-en-29-al, 3,16,28-trihydroxy-, (3beta,16alpha,20beta)-|(2S,4aS,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5,10-dihydroxy-4a-(hydroxymethyl)-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carbaldehyde|(2S,4AS,5R,6AS,6BR,8AR,10S,12AR,12BR,14BS)-5,10-DIHYDROXY-4A-(HYDROXYMETHYL)-2,6A,6B,9,9,12A-HEXAMETHYL-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-ICOSAHYDROPICENE-2-CARBALDEHYDE

Molecular Formula	C30H48O4
Molecular Weight	472.35526 g/mol
LogP	5.2911
Topological Polar Surface Area	77.76 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	472.35526
Monoisotopic Mass	472.35526
Heavy Atoms	34
Complexity	894.2362

Chemical Identifiers

CAS Number	5172-35-0
SMILES	C[C@@]1(CC[C@]2([C@@H](C1)C3=CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(C[C@H]2O)C)C)(C)C)O)C)CO)C=O