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vellosimine

MNXM162561 is deprecated and here replaced by MNXM1371242
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371242 Image of MNXM1371242
referencechebi:18057
formulaC19H20N2O
global charge0
mol weight292.382
InChIKeyMHASSCPGKAMILD-VICVVEARSA-N
InChIInChI=1S/C19H20N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,10,13,15,17-18,20H,7-9H2,1H3/b11-2-/t13-,15+,17-,18-/m0/s1
SMILESC/C=C1/CN2C3CC4=C(NC5=CC=CC=C54)[C@@H]2C[C@@H]1[C@H]3C=O
MNX internals
InChI (mnx)InChI=1/C19H20N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,10,13,15,17-18,20H,7-9H2,1H3/b11-2-/t13-,15+,17-,18-/m0/s1 Image of MNXM1371242
SMILES (mnx)[CH3:1]/[CH:2]=[C:11]1/[CH2:9][N:21]2[C@H:17]3[CH2:8][C:14]4=[C:19]([C@@H:18]2[CH2:7][C@@H:13]1[C@H:15]3[CH:10]=[O:22])[NH:20][C:16]1=[CH:6][CH:4]=[CH:3][CH:5]=[C:12]41
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:18057
chebi:18057
MHASSCPGKAMILD-VICVVEARSA-N 		vellosimine
(+)-vellosimine
Vellosimine
sarpagan-17-al

kegg.compound:C11634
keggC:C11634
MHASSCPGKAMILD-VICVVEARSA-N 		Vellosimine

seed.compound:cpd08445
seedM:cpd08445
MHASSCPGKAMILD-VICVVEARSA-N 		Vellosimine
vellosimine

chebi:15305
chebi:57765
chebi:58362
chebi:9942
keggC:M_C11634
seedM:M_cpd08445 		secondary/obsolete/fantasy identifier