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isolapidilectine A

PropertiesImage
MNX_IDMNXM105824 Image of MNXM105824
referencechebi:68091
formulaC24H28N2O6
global charge0
mol weight440.496
InChIKeyYLBUDFTWGUSIKB-SFUZCSOBSA-N
InChIInChI=1S/C24H28N2O6/c1-30-19(27)17-15-22-9-6-13-25(22)14-12-23(20(28)31-2)16-7-4-5-8-18(16)26(21(29)32-3)24(17,23)11-10-22/h4-9,17H,10-15H2,1-3H3/t17-,22-,23-,24-/m1/s1
SMILESCOC(=O)[C@H]1C[C@]23C=CCN2CC[C@]2(C(=O)OC)C4=C(C=CC=C4)N(C(=O)OC)[C@]12CC3
MNX internals
InChI (mnx)InChI=1/C24H28N2O6/c1-30-19(27)17-15-22-9-6-13-25(22)14-12-23(20(28)31-2)16-7-4-5-8-18(16)26(21(29)32-3)24(17,23)11-10-22/h4-9,17H,10-15H2,1-3H3/t17-,22-,23-,24-/m1/s1 Image of MNXM105824
SMILES (mnx)[CH3:1][O:30][C:19]([C@H:17]1[CH2:15][C@:22]23[CH:9]=[CH:6][CH2:13][N:25]2[CH2:14][CH2:12][C@:23]2([C:20](=[O:28])[O:31][CH3:2])[C:16]4=[CH:7][CH:4]=[CH:5][CH:8]=[C:18]4[N:26]([C:21](=[O:29])[O:32][CH3:3])[C@:24]12[CH2:11][CH2:10]3)=[O:27]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:68091
chebi:68091
YLBUDFTWGUSIKB-SFUZCSOBSA-N
isolapidilectine A
Trimethyl (1R,9S,16R,18S)-2,12-diazapentacyclo[14.2.2.0[1,9].0[3,8].0[12,16]]icosa-3,5,7,14-tetraene-2,9,18-tricarboxylate