ID: 89461
SMILES:C1(C(=C)C)CCC(CO)(Oc2ccc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.948
InChIKey:GNMHODFVEWLEGH-UHFFFAOYSA-N
ID: 89462
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 89463
SMILES:C1(CC(C=CC)=O)C(C)(C)Oc2cc(CCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.439
InChIKey:BQHKKIMRJFZEKV-UHFFFAOYSA-N
ID: 89464
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -14.327
InChIKey:OMKDQTQBXBEXSQ-UHFFFAOYSA-N
ID: 89465
SMILES:C1CC(C)(C)C2C(O)(C=C1C)c1c(cc(CCCCO)cc1O)CC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.784
InChIKey:KYAYFUOSZSGZQC-UHFFFAOYSA-N
ID: 89466
SMILES:c1(OCCOc2ccccc2OC)cc2c(cc1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -16.393
InChIKey:MYGXFXQVQMBSSW-UHFFFAOYSA-N
ID: 89467
SMILES:CC1(C)Oc2cc(-c3c(O)cc(CCCCC)c(O)c3O)c(O)cc2C1CC(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.621
InChIKey:ZNWJFCPFRBTXKM-UHFFFAOYSA-N
ID: 89468
SMILES:c1(CCCCC)cc2c3c(c1O)C1(C)C(=C(C)CC2)CC(CC=C(C)C)(C1(C)C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -13.571
InChIKey:RAXBISPVEGOCBZ-UHFFFAOYSA-N
ID: 89469
SMILES:C1(C)=CCC(CO)C(C(CCCCCC)C)C1c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.749
CB1 binding score: -16.705
InChIKey:ORDXOUICAYFFAW-UHFFFAOYSA-N
ID: 89470
SMILES:C1(C)(CCC=C(C)C)C2CCC(C)=CC1c1c(cc(CCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.552
InChIKey:RXXYMQFATDVOEN-UHFFFAOYSA-N
ID: 89471
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)c(CC(C(C)=C)CCC(C)CCC=C(C)C)c(O)c3O)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.732
CB1 binding score: -14.038
InChIKey:FYMCWSCMBDJFLK-UHFFFAOYSA-N
ID: 89472
SMILES:O1c2cc(CCCCC)c(C(=O)O)c(O)c2C=CC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 89473
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2CCC(C)CC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -15.288
InChIKey:JKJXVJYVFJIWIV-UHFFFAOYSA-N
ID: 89474
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CCC(C=O)=CCCC2C)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.957
InChIKey:QCGOGPJYOWVIIO-UHFFFAOYSA-N
ID: 89475
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(=C)C2O)CCC2(O)C1(C)CCC(=O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.041
InChIKey:FKXOQADRRDKKJS-UHFFFAOYSA-N
ID: 89476
SMILES:CC1=CC2c3c(O)c(c(=O)cc(C)c3)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.764
InChIKey:LQDRIHUNPLULFZ-UHFFFAOYSA-N
ID: 89477
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 89478
SMILES:c1c(C(=O)C=CC(=CC(C)C(C(CC)C)C)C)cc(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -13.625
InChIKey:JHVYVSAECRMEEU-UHFFFAOYSA-N
ID: 89479
SMILES:c12c(c(O)cc(CCCCC)c1)C1OC3(C)OCC(C)C3CC1C(O)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.044
InChIKey:CFVNWKQPGWMXCN-UHFFFAOYSA-N
ID: 89480
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1(O2)CC2(C)C(O2)CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.565
InChIKey:XPBVYUSPZMELPB-UHFFFAOYSA-N
ID: 89481
SMILES:c1c2c(c(O)c(CC=C(C)C)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.813
InChIKey:ZABMCKWSCPPFIU-UHFFFAOYSA-N