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5alpha-Androstane-3alpha,17alpha-diol

Properties

Image

Occurences in reactions

MNX_ID

MNXM1106953

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₁₉H₃₂O₂

charge

mass

292.24023

reference

sabiorkM:28097

InChIKey

CBMYJHIOYJEBSB-CUZKMJQKSA-N

InChI

InChI=1S/C19H32O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-17,20-21H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,17+,18-,19-/m0/s1

SMILES

C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@H]2O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
sabiork.compound:28097 sabiorkM:28097	5alpha-Androstane-3alpha,17alpha-diol
lipidmaps:LMST02020096 lipidmapsM:LMST02020096	5a-Androstane-3a,17a-diol O2 ST 19:0
hmdb:HMDB0000458	5alpha-Androstane-3alpha,17alpha-diol (1S,2S,5R,7S,10R,11S,14R,15S)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,14-diol (3alpha,5alpha,17alpha)-Androstane-3,17-diol 3a,17a-Dihydroxy-5a-androstane 3alpha,17alpha-Dihydroxy-5alpha-androstane 5alpha-Androstan-3alpha,17alpha-diol
hmdb:HMDB00458	secondary/obsolete/fantasy identifier