ID: 22429
SMILES:c12c(CCCCCC)cc(O)cc1OC(C)(C)C1CCC(C)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.015
InChIKey:NLRNJHDPBDVGCU-UHFFFAOYSA-N
ID: 22430
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(C(O)(C)C)OC(C2)C1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -14.216
InChIKey:LWANHPAIPHSJMK-UHFFFAOYSA-N
ID: 22431
SMILES:c1(O)cc(CCCCC)cc2c1OC(C)(C)C1CCC(=C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.288
InChIKey:POKHMNVTNFIRKS-UHFFFAOYSA-N
ID: 22432
SMILES:C(C)(Cl)Cc1cc(O)c(C2C=C(CO)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.875
CB1 binding score: -14.553
InChIKey:CKIGECNVMCMTIZ-UHFFFAOYSA-N
ID: 22433
SMILES:OC1C(O)C(O)C(OC2c3c(cc(C)cc3O)OCC(C)=CCC=C2C)OC1CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.474
CB1 binding score: -15.467
InChIKey:VOHDMJYKYLHQMT-UHFFFAOYSA-N
ID: 22434
SMILES:C12C(C)(C)CC(OC(=O)C)CC1(C)Oc1c(c(O)cc(CCCCCC)c1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.754
InChIKey:VFMDIUPBNXISLX-UHFFFAOYSA-N
ID: 22435
SMILES:C(C)Cc1cc(O)c2c(c1)OC1(C)CCC(C(C)C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.233
InChIKey:UUPRLZQTJXOWLX-UHFFFAOYSA-N
ID: 22436
SMILES:C(c1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.306
InChIKey:BETAZIWVUZITHJ-UHFFFAOYSA-N
ID: 22437
SMILES:C1(C)=CC(c2c(O)ccc(CCc3ccccc3)c2)C(C(=C)CC=CC(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.605
CB1 binding score: -15.145
InChIKey:ONPDXZAIIWGXDF-UHFFFAOYSA-N
ID: 22438
SMILES:C1CC(C)C2(OC)C(C(C)(C)Oc3c2c(OC)cc(CCCCC)c3)C2CC(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.684
CB1 binding score: -16.189
InChIKey:RZIQBOHRTAMKBX-UHFFFAOYSA-N
ID: 22439
SMILES:c1(=O)cc(C)c(C(CCCC)C(O)=O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.397
InChIKey:BCMRPVLVTVBWEH-UHFFFAOYSA-N
ID: 22440
SMILES:O=C(C1=C(CCCC)C(=O)C2=C3OC(CCC(C)=C1)C(C)(C)OC3=CC(=O)C2)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -15.269
InChIKey:VWPZUANLGOTXNL-UHFFFAOYSA-N
ID: 22441
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2O)C2C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.013
InChIKey:FIDKGSUOJDYLDC-UHFFFAOYSA-N
ID: 22442
SMILES:CC(C)=CCCC(=CCOc1cc(CCCCC)cc(OC)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.415
InChIKey:DAXDAENASGNQSJ-UHFFFAOYSA-N
ID: 22443
SMILES:c12c(O)cc(O)c(C=O)c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 22444
SMILES:C1CC(C)(CCC=C(C)C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 22445
SMILES:C1C=CCC(C)(C)Oc2c(O)c(CCCCC)c(C(=O)O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.254
InChIKey:JTBHXXVGVWPGKP-UHFFFAOYSA-N
ID: 22446
SMILES:C1C(C(C)(O)C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.722
InChIKey:BKMHHCHEXYBYLF-UHFFFAOYSA-N
ID: 22447
SMILES:CC1(C)C2C(c3c(O)cc4c(c3O)CC(O)C(CCC=C(C)C)(C)O4)CC(C(C)(O)C)C=C2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -13.435
InChIKey:MXIHZEJJRBAYGV-UHFFFAOYSA-N
ID: 22448
SMILES:CC(C)=CC(C(O)C1(C)CC2C1CCC1(C)C(O)(C2)c2c(cc(CCCCC)cc2O)O1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.047
InChIKey:WJTDVPZMRSZGJP-UHFFFAOYSA-N
ID: 22449
SMILES:C(C=C(C)CCC=C(C)C)CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N