GABUNINE
Molecular Formula:
C42H50N4O5
InChI: InChI=1/C42H50N4O5/c1-6-23-14-22-19-42(41(48)51-5)38-26(12-13-46(21-22)39(23)42)28-18-35(49-3)29(16-33(28)45-38)30-15-27-24(7-2)20-43-34(36(27)40(47)50-4)17-31-25-10-8-9-11-32(25)44-37(30)31/h7-11,16,18,22-23,27,30,34,36,39,43-45H,6,12-15,17,19-21H2,1-5H3/b24-7-/t22-,23-,27-,30+,34+,36u,39-,42+/m0/s1
InChIKey: InChIKey=XVSWNFDALFLWFM-LYBARVKQBR
SMILES: CCC1CC2CC3(C1N(C2)CCC4=C3NC5=CC(=C(C=C45)OC)C6CC7C(C(CC8=C6NC9=CC=CC=C89)NCC7=CC)C(=O)OC)C(=O)OC
Names:
C09195
GABUNINE
1357-30-8
Registries:
PubChem CID 11953929
PubChem ID 11387
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