ID: 110461
SMILES:C1CC(C(=C)C)C(c2c(OC)ccc(CCN(C)C)c2)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 110462
SMILES:C(=CCCC1(C)Oc2cc(C)cc(O)c2C2C1C(C)(CCCC(O)(C)C)CCC2)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.465
InChIKey:LDNQQMVLVAGTBN-UHFFFAOYSA-N
ID: 110463
SMILES:OC(C(C)(Cl)C(O)COc1c2c(cc(CCCCC)c1)OC(C)(C)C(O)CC2)CC(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 539.197
CB1 binding score: -13.551
InChIKey:KLAUEUUEPGPSMD-UHFFFAOYSA-N
ID: 110464
SMILES:C1C(C(=C)C)C(c2ccc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 110465
SMILES:C(C(C)=CCCC1(C)CCc2c(O)cc(CCCCC)cc2O1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.251
InChIKey:FBACSUXJOZUQHN-UHFFFAOYSA-N
ID: 110466
SMILES:c1(OC)c(C2C=C(C)CCC2C(C)=C)c(O)c(C=O)c(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -17.167
InChIKey:XVCWVEVXXHNEHV-UHFFFAOYSA-N
ID: 110467
SMILES:C1=C(C)CC(c2c(OC)cc(OC)cc2CC=C(C)C)(C(C)=C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.946
InChIKey:BQCMNUFJEWSCLB-UHFFFAOYSA-N
ID: 110468
SMILES:c1(O)c(CC=C(C)CCC=C(C(=O)O)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -17.004
InChIKey:RMPQXUPEZIOCPJ-UHFFFAOYSA-N
ID: 110469
SMILES:c1c(CCCCC)c(C2C(C(C)=C)C(c3cc(O)c(O)cc3)C=C(C)C2)c(O)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.575
CB1 binding score: -16.109
InChIKey:NNGYVJZMZGBSDE-UHFFFAOYSA-N
ID: 110470
SMILES:c1(O)c2c(c(C(O)=O)c(CCCCC)c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.502
InChIKey:NQADZCDEBCHREE-UHFFFAOYSA-N
ID: 110471
SMILES:C(C=C(C)CCCC(C)(CO)O)Cc1cc2c(cc1)C1C(CCC(O)(C)C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -17.55
InChIKey:MBOQUPVUQJKZFT-UHFFFAOYSA-N
ID: 110472
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: 110473
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(CCCC(O)(C)C)C(=O)CC1(C)CC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -14.934
InChIKey:UYLSVSBNQLKFDT-UHFFFAOYSA-N
ID: 110474
SMILES:C1C(C)C(=O)CC(C(C)=C)Cc2oc(cc2CCCCC)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.166
InChIKey:NZAQHFDLIBQPSM-UHFFFAOYSA-N
ID: 110475
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 110476
SMILES:C1(C)=CC(c2c(O)cc(OC)c(C=O)c2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.289
InChIKey:CVTBYPOCGQPUJM-UHFFFAOYSA-N
ID: 110477
SMILES:c1c(CCCCC)cc2c(c1)OC(CCC=C(C)CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -16.943
InChIKey:OPCJMYVYOPKLJI-UHFFFAOYSA-N
ID: 110478
SMILES:C1C23Cc4c(O)cc(CCCCC)cc4OC(C)(C)C2CC(O1)C(C)C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.658
InChIKey:QHGPFSHHLHUCED-UHFFFAOYSA-N
ID: 110479
SMILES:N(C1(C)C2C(c3c(O)cc(CCCCC)cc3O1)CC(CCC=C(C)C)=CC2)C(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.613
CB1 binding score: -15.367
InChIKey:BUEVJBFTTIUZKE-UHFFFAOYSA-N
ID: 110480
SMILES:C1=C(c2ccccc2)C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.605
CB1 binding score: -16.491
InChIKey:LPFCOLRTYJOHJC-UHFFFAOYSA-N
ID: 110481
SMILES:CC12C(=C(C(C)CO)C(OC(=O)C)C1OC(=O)C)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.513
CB1 binding score: -13.996
InChIKey:PNDOKZZSTHUBRV-UHFFFAOYSA-N