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diosgenin

MNXM89243 is deprecated and here replaced by MNXM741120
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM741120

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₂₇H₄₂O₃

charge

mass

414.3134

reference

chebi:4629

InChIKey

WQLVFSAGQJTQCK-VKROHFNGSA-N

InChI

InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1

SMILES

C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]32C)O[C@]12CC[C@@H](C)CO2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:4629 chebi:4629	diosgenin (20R,25R)-spirost-5-en-3beta-ol (25R)-spirost-5-en-3beta-ol (3beta,25R)-spirost-5-en-3-ol nitogenin
seed.compound:cpd33475 seedM:cpd33475	(3beta,25R)-spirost-5-en-3-ol diosgenin
lipidmaps:LMST01080037 lipidmapsM:LMST01080037	Diosgenin (25R)-spirost-5-en-3beta-diol O3 ST 27:3
seed.compound:cpd05795 seedM:cpd05795 kegg.compound:C08898 keggC:C08898	Diosgenin (3beta,25R)-Spirost-5-en-3-ol
metacyc.compound:CPD-15437 metacycM:CPD-15437	diosgenin (3beta,25R)-spirost-5-en-3-ol
chebi:67838 keggC:M_C08898 seedM:M_cpd05795 seedM:M_cpd33475	secondary/obsolete/fantasy identifier