ID: 116215
SMILES:c12c(OC)cc(CCCCC)cc1C1C=C(C=O)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.553
InChIKey:RFOVPUWUNACAKK-UHFFFAOYSA-N
ID: 116216
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 116217
SMILES:C1C(O)C(O)C(CO)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -10.125
InChIKey:ADRMHXNXVXNEPU-UHFFFAOYSA-N
ID: 116218
SMILES:Oc1cc2c(cc1Br)C1(CC=O)C(C(C)(C)O2)CCC(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.277
CB1 binding score: -14.314
InChIKey:OUFKDORNDQXDIT-UHFFFAOYSA-N
ID: 116219
SMILES:C(=CCc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(O)C(C)(O)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.519
InChIKey:PRBYZJPBTVHWQB-UHFFFAOYSA-N
ID: 116220
SMILES:C(CCC)Cc1c(O)c2c(c3c1OC(C)(C)C(O)C3)CCC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.283
InChIKey:FNYSZJNYXYFPHR-UHFFFAOYSA-N
ID: 116221
SMILES:c12c(O)cc(CCCCC)cc1OC1(C)CCC(C(C)(C)O)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.714
InChIKey:WHDCWMKMQFXAGU-UHFFFAOYSA-N
ID: 116222
SMILES:Oc1cc(C)cc2c1C1C(C(O)(C)CCC1C(C)=C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.646
InChIKey:JUEQMXVOZPWLKJ-UHFFFAOYSA-N
ID: 116223
SMILES:c1(OC)c(CC=C(C)C)c(O)cc(CCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.515
InChIKey:BATMCKVCWPMDGH-UHFFFAOYSA-N
ID: 116224
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1(O)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.56
InChIKey:VBPOXSBFZQHISD-UHFFFAOYSA-N
ID: 116225
SMILES:CC(=O)OC1(C)CC(=O)C(C(C)CCC=C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -16.769
InChIKey:LMOAJONGIQKVLT-UHFFFAOYSA-N
ID: 116226
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 116227
SMILES:c1(O)c2c(cc(CCCCC)c1)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: 116228
SMILES:c1(C(C)(C)O)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 320.429
CB1 binding score: -14.461
InChIKey:ISHBOPMLBIEMKK-UHFFFAOYSA-N
ID: 116229
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 116230
SMILES:c1c(C2(O)CC(C)(C)CC2C=C(C)CO)c(CCCCC)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -14.452
InChIKey:DVUORMYMPDDYIJ-UHFFFAOYSA-N
ID: 116231
SMILES:c1(O)c(C2C=C(CCC=C(CCC=C(C)C)C)C(=O)C(C)=C2O)c2c(c(C(=O)c3ccccc3)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 636.829
CB1 binding score: -13.962
InChIKey:YYLYNWASZUPIOO-UHFFFAOYSA-N
ID: 116232
SMILES:c1(O)c(C)ccc2c1C1C=C(C)CCC1C(C)(CO)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -13.842
InChIKey:CMBLLEHVZRTPFX-UHFFFAOYSA-N
ID: 116233
SMILES:CC(C)(O)C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.943
InChIKey:VXGKLDGOVIXPAH-UHFFFAOYSA-N
ID: 116234
SMILES:C12(C)OCC(C)C1CC1C(C)(Oc3cc(OC)cc(CCCCC)c3C1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -11.209
InChIKey:AEFCCKLOOMVPKP-UHFFFAOYSA-N
ID: 116235
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CC(C=C(C)C)(C=C(C)C)C1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.886
InChIKey:WGLIINLIUSPWBL-UHFFFAOYSA-N