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3beta,16alpha-dihydroxy-androst-5-en-17-one

MNXM163801 is deprecated and replaced by MNXM2595
PropertiesImage
MNX_IDMNXM2595 Image of MNXM2595
referencechebi:27771
formulaC19H28O3
global charge0
mol weight304.43
InChIKeyQQIVKFZWLZJXJT-DNKQKWOHSA-N
InChIInChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-16,20-21H,4-10H2,1-2H3/t12-,13+,14-,15-,16+,18-,19-/m0/s1
SMILESC[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)[C@H](O)C[C@@H]12
MNX internals
InChI (mnx)InChI=1/C19H28O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-16,20-21H,4-10H2,1-2H3/t12-,13+,14-,15-,16+,18-,19-/m0/s1 Image of MNXM2595
SMILES (mnx)[CH3:1][C@:18]12[CH2:7][CH2:5][C@H:12]([OH:20])[CH2:9][C:11]1=[CH:3][CH2:4][C@@H:13]1[C@@H:14]2[CH2:6][CH2:8][C@@:19]2([CH3:2])[C@H:15]1[CH2:10][C@@H:16]([OH:21])[C:17]2=[O:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)11
in models (compartimentalized) 9
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27771
chebi:27771
QQIVKFZWLZJXJT-DNKQKWOHSA-N 		3beta,16alpha-dihydroxy-androst-5-en-17-one
16alpha-Hydroxydehydroepiandrosterone
16alpha-Hydroxydehydroisoandrosterone
16alpha-hydroxydehydroepiandrosterone
3beta,16alpha-dihydroxyandrost-5-en-17-one
5-Androstene-3beta,16alpha-diol-17-one
hmdb:HMDB0000352
QQIVKFZWLZJXJT-DNKQKWOHSA-N 		16a-Hydroxydehydroisoandrosterone
(1S,2R,5S,10R,11S,13R,15S)-5,13-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-en-14-one
16 alpha-Hydroxy-dehydroepiandrosterone
16 alpha-Hydroxydehydroisoandrosterone
16 beta-Hydroxydehydroepiandrosterone
16-Hydroxydehydroandrosterone
16-Hydroxydehydroepiandrosterone
16-Hydroxydehydroepiandrosterone, (16beta)-isomer
16-Hydroxydehydroepiandrosterone, (3alpha,16alpha)-isomer
16a-Hydroxy-DHEA
16a-Hydroxy-dhea
16a-Hydroxydehydroandrosterone
16a-Hydroxydehydroepiandrosterone
16alpha-Hydroxy-dehydroepiandrosterone
16alpha-Hydroxydehydroisoandrosterone
16alpha-hydroxydehydroepiandrosterone
16alpha-hydroxydehydroisoandrosterone
3 beta,16 alpha-Dihydroxyandrost-5-en-17-one
3 beta,16 beta-Dihydroxyandrost-5-en-17-one
3,16-Dihydroxyandrost-5-en-17-one
3b,16a-Dihydroxy-androst-5-en-17-one
3b,16a-Dihydroxyandrost-5-en-17-one
3beta,16alpha-Dihydroxy-androst-5-en-17-one
3beta,16alpha-Dihydroxyandrost-5-en-17-one
3beta,16alpha-dihydroxy-androst-5-en-17-one
5-Androstene-3b,16a-diol-17-one
5-Androstene-3beta,16alpha-diol-17-one
Androst-5-ene-3b-16a-diol-17-one

lipidmaps:LMST02020064
lipidmapsM:LMST02020064
QQIVKFZWLZJXJT-DNKQKWOHSA-N 		16alpha-Hydroxydehydroepiandrosterone
3beta,16alpha-dihydroxy-5-androsten-17-one
O3
ST 19:2

seed.compound:cpd03059
seedM:cpd03059
kegg.compound:C05139
keggC:C05139
QQIVKFZWLZJXJT-DNKQKWOHSA-N 		16alpha-Hydroxydehydroepiandrosterone
5-Androstene-3beta,16alpha-diol-17-one

bigg.metabolite:eandrstrn
biggM:eandrstrn
QQIVKFZWLZJXJT-DNKQKWOHSA-N 		16alpha-hydroxydehydroepiandrosterone

vmhM:eandrstrn
vmhmetabolite:eandrstrn
QQIVKFZWLZJXJT-DNKQKWOHSA-N 		16alpha-hydroxydehydroepiandrosterone
(1S,2R,5S,10R,11S,13R,15S)-5,13-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-en-14-one

SLM:000501287
slm:000501287
QQIVKFZWLZJXJT-DNKQKWOHSA-N 		3beta,16alpha-dihydroxy-androst-5-en-17-one

hmdb:HMDB00352
chebi:19163
chebi:775
biggM:M_eandrstrn
keggC:M_C05139
seedM:M_cpd03059
vmhM:M_eandrstrn 		secondary/obsolete/fantasy identifier