ID: 110440
SMILES:C(CCCc1cc(O)c2c(c1CC=C(C)C)OC(C)(C)C=C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.216
InChIKey:WVOCTOIDHOXIKB-UHFFFAOYSA-N
ID: 110441
SMILES:C(CCCc1cc(O)c(C2CC(C)=CC(=O)C2)c(O)c1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.306
InChIKey:AAEOAEVMGJUAGR-UHFFFAOYSA-N
ID: 110442
SMILES:C12CC(C(C(OC)=O)=C)CCC1(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.713
InChIKey:QWZWVMQTALSYTI-UHFFFAOYSA-N
ID: 110443
SMILES:C12C(C(O)CC(CCC=C)=C1)C(C)(C)Oc1c2ccc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -14.112
InChIKey:YNDWSYVPARPVAC-UHFFFAOYSA-N
ID: 110444
SMILES:N(CC=C(CO)C)COc1cc(CCCCC)cc(O)c1C1C(C(C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 429.645
CB1 binding score: -18.059
InChIKey:NMNFFTXGZFYUAM-UHFFFAOYSA-N
ID: 110445
SMILES:CC1=CC(c2c(OC)cc(OC)cc2C)C(C(C)=C)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.152
InChIKey:BSQXXCNDRYIJNV-UHFFFAOYSA-N
ID: 110446
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 110447
SMILES:C1C(C(C)(C)O)CC(=O)C2(C)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.419
InChIKey:FZUNFHRVXBRBSK-UHFFFAOYSA-N
ID: 110448
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 110449
SMILES:C(=CCc1c(O)c(C)cc(O)c1)(CCC1OC(C)(C)C(O)CCC1=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.203
InChIKey:IKJPRSXVDMWKEM-UHFFFAOYSA-N
ID: 110450
SMILES:COc1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.482
InChIKey:CIDQYVCFMPFXCM-UHFFFAOYSA-N
ID: 110451
SMILES:CC(=O)OC1C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.665
InChIKey:QGCMZLCMJQZIRM-UHFFFAOYSA-N
ID: 110452
SMILES:C1(C)COc2c(c(O)cc(CCCCC)c2)C1C=C(C=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.628
InChIKey:ARXLRUWBHVKDBN-UHFFFAOYSA-N
ID: 110453
SMILES:c1(C(C)C)cc(Br)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 349.312
CB1 binding score: -14.985
InChIKey:JCZCDRQELOYCII-UHFFFAOYSA-N
ID: 110454
SMILES:Oc1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 110455
SMILES:c12c3c(ccc1C(=O)c1c(O)cc(C)cc1OC2(C)C)C(C)(C)C(C=CC(C)=C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.534
CB1 binding score: -15.295
InChIKey:LAYPWCNANVZWPE-UHFFFAOYSA-N
ID: 110456
SMILES:O(c1cc(C2C(C(=C)C)CC(OC(C)=O)C(C)=C2)c(CCC(C)C)c(O)c1OC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -16.054
InChIKey:PPYDNLRUIQGSKP-UHFFFAOYSA-N
ID: 110457
SMILES:O1c2c(c(O)cc(CCc3ccccc3)c2)C=CC1(CCC=C(C)CCC=C(C)CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.724
CB1 binding score: -15.274
InChIKey:PZLJYKSOYOEXRR-UHFFFAOYSA-N
ID: 110458
SMILES:Brc1c2c(c(CCCCC)cc1O)OC1(C(C)C)CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.365
CB1 binding score: -14.605
InChIKey:JAIJZQREYVBEKI-UHFFFAOYSA-N
ID: 110459
SMILES:C12C(C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 110460
SMILES:COc1c(O)cc(C)c(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.527
InChIKey:ABPHQODQYTYRRD-UHFFFAOYSA-N