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13-Hydroxylupanine

MNXM3790 is deprecated and here replaced by MNXM1371286
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371286 Image of MNXM1371286
referencekeggC:C02621
formulaC15H24N2O2
global charge0
mol weight264.369
InChIKeyJVYKIBAJVKEZSQ-YHQUGGNUSA-N
InChIInChI=1S/C15H24N2O2/c18-12-4-5-16-8-10-6-11(14(16)7-12)9-17-13(10)2-1-3-15(17)19/h10-14,18H,1-9H2/t10-,11-,12-,13+,14-/m0/s1
SMILESO=C1CCC[C@@H]2[C@H]3C[C@@H](CN12)[C@@H]1C[C@@H](O)CCN1C3
MNX internals
InChI (mnx)InChI=1/C15H24N2O2/c18-12-4-5-16-8-10-6-11(14(16)7-12)9-17-13(10)2-1-3-15(17)19/h10-14,18H,1-9H2/t10-,11-,12-,13+,14-/m0/s1 Image of MNXM1371286
SMILES (mnx)[CH2:1]1[CH2:2][C@@H:13]2[C@H:10]3[CH2:6][C@@H:11]([CH2:9][N:17]2[C:15](=[O:19])[CH2:3]1)[C@@H:14]1[CH2:7][C@@H:12]([OH:18])[CH2:4][CH2:5][N:16]1[CH2:8]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

kegg.compound:C02621
keggC:C02621
JVYKIBAJVKEZSQ-YHQUGGNUSA-N 		13-Hydroxylupanine
(+)-13alpha-Hydroxylupanine
13-Hydroxylupinine

keggC:M_C02621 		secondary/obsolete/fantasy identifier