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1-[(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methoxy]-3-(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-propanol

PropertiesImage
MNX_IDMNXM340668 Image of MNXM340668
referencechebi:108500
formulaC21H32N2O2
global charge0
mol weight344.499
InChIKeyMPMBMMNKHZRACQ-UHFFFAOYSA-N
InChIInChI=1S/C21H32N2O2/c1-15-20-5-4-8-22(20)9-10-23(15)12-18(24)14-25-13-16-6-7-17-11-19(16)21(17,2)3/h4-6,8,15,17-19,24H,7,9-14H2,1-3H3
SMILESCC1C2=CC=CN2CCN1CC(O)COCC1=CCC2CC1C2(C)C
MNX internals
InChI (mnx)InChI=1/C21H32N2O2/c1-15-20-5-4-8-22(20)9-10-23(15)12-18(24)14-25-13-16-6-7-17-11-19(16)21(17,2)3/h4-6,8,15,17-19,24H,7,9-14H2,1-3H3/t15?,17?,18?,19? Image of MNXM340668
SMILES (mnx)[CH3:1][CH:15]1[C:20]2=[CH:5][CH:4]=[CH:8][N:22]2[CH2:9][CH2:10][N:23]1[CH2:12][CH:18]([CH2:14][O:25][CH2:13][C:16]1=[CH:6][CH2:7][CH:17]2[CH2:11][CH:19]1[C:21]2([CH3:2])[CH3:3])[OH:24]
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:108500
chebi:108500
MPMBMMNKHZRACQ-UHFFFAOYSA-N
1-[(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methoxy]-3-(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-propanol