ID: 112519
SMILES:CC(C1Cc2c(c(O)cc(CCCCC)c2)C2C(C)CCC2C1=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -14.45
InChIKey:AVJHWFBQEYBHQA-UHFFFAOYSA-N
ID: 112520
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 112521
SMILES:C1(C)(C=C)CCC(C(=C)C)CC1c1cc(CCCCC)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -16.768
InChIKey:FKFZPSQPMMDFJK-UHFFFAOYSA-N
ID: 112522
SMILES:c1(C(C)(C)C)ccc2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.228
InChIKey:WBTQTWIDQKIEBL-UHFFFAOYSA-N
ID: 112523
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(OC)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 112524
SMILES:CCCOc1cc(C)cc(O)c1C1CC(C)(CCC=C(C)C)Oc2c1cccc2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -17.016
InChIKey:URIAAQNJKLOYKO-UHFFFAOYSA-N
ID: 112525
SMILES:c12c(cc(CCCC)cc1O)OC(C)(C)C1CC=C(C)C(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.687
InChIKey:GXVDYEDWOQVSAM-UHFFFAOYSA-N
ID: 112526
SMILES:C(=C)(C)C1=CCC(C)C1c1c(OC)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.055
InChIKey:JZXBCWJIVXCKCC-UHFFFAOYSA-N
ID: 112527
SMILES:CCCC(=O)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.263
InChIKey:PFVXVFHRRRHRTH-UHFFFAOYSA-N
ID: 112528
SMILES:C1CC(CO)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.731
InChIKey:SXQMCNAZBAENPK-UHFFFAOYSA-N
ID: 112529
SMILES:c1(CCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 112530
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 112531
SMILES:c1(C(C)C)cc(O)c2c(c1)OC1(C)C(C2)C(C)(C)C(Br)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 367.327
CB1 binding score: -16.714
InChIKey:NYZUBRYOXNOVBG-UHFFFAOYSA-N
ID: 112532
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC3(C)C(CCC(C)=CC3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -12.523
InChIKey:TVRQRACICYPUBX-UHFFFAOYSA-N
ID: 112533
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O1)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 112534
SMILES:C(=O)(OCC1C(C)(C)O1)c1c(C2C(C(C(O)=O)C)CCC(C)=C2)c(C)c(CC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -13.362
InChIKey:OMZPCBJQDWHMGO-UHFFFAOYSA-N
ID: 112535
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.385
InChIKey:OEDPJGVWHANUAE-UHFFFAOYSA-N
ID: 112536
SMILES:O=C1C(C#N)(C)CC(=C2C(CCC=C(C)C)(C)C(C(C)C)C1)COc1cc3c(cc12)OC(C)(C)C=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 487.684
CB1 binding score: -15.279
InChIKey:WRFWEGLYVYSCSE-UHFFFAOYSA-N
ID: 112537
SMILES:C1(C(C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 112538
SMILES:c1(C)cc2c(cc1C(=O)O)C(C)(C)Oc1cc(CCCCC)cc(O)c1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.086
InChIKey:IKCGZBDAUUGKDJ-UHFFFAOYSA-N
ID: 112539
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C1C(O)C(O)C(O)C(CO)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.556
CB1 binding score: -15.178
InChIKey:IXNABQTVTQEYDM-UHFFFAOYSA-N