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Cadabicine

PropertiesImageOccurences in reactions
MNX_IDMNXM120008Image of MNXM120008
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC25H29N3O4
charge0
mass435.21581
referencehmdb:HMDB0033451
InChIKeyQBKGCCSZLPZTIE-AJDRMPRJSA-N
InChIInChI=1S/C25H29N3O4/c29-22-11-6-20-8-13-25(31)27-16-2-1-14-26-15-3-17-28-24(30)12-7-19-4-9-21(10-5-19)32-23(22)18-20/h4-13,18,26,29H,1-3,14-17H2,(H,27,31)(H,28,30)/b12-7-,13-8-
SMILESOC1=NCCCCNCCCN=C(O)/C=C\c2ccc(cc2)Oc2cc(ccc2O)/C=C\1
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0033451 Cadabicine
(8E,22E)-2-oxa-11,16,20-triazatricyclo[22.2.2.1³,⁷]nonacosa-1(26),3,5,7(29),8,10,20,22,24,27-decaene-4,10,21-triol
hmdb:HMDB33451 secondary/obsolete/fantasy identifier