ID: 84694
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 84695
SMILES:O1c2c(cc(CCCCC)cc2O)C2C(C)(O2)CCC=C(C)CCC1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.084
InChIKey:NLTXPEOGSRQUMG-UHFFFAOYSA-N
ID: 84696
SMILES:C(C)CCCc1c(O)cc2c(c1O)C1C(C(C)(CCC=C(C)C)O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.772
InChIKey:SVJQXRHLOKDLAD-UHFFFAOYSA-N
ID: 84697
SMILES:CCCCCc1cc2c(c(O)c1)C1(O)C(CC(C)(C)OC1(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -10.648
InChIKey:QVLQBLKZISWHBA-UHFFFAOYSA-N
ID: 84698
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1(O)C1(C)CCC(=O)C(C)(C)C1CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.551
InChIKey:HIUONJHGKAROLC-UHFFFAOYSA-N
ID: 84699
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 84700
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2CC(C)(O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.25
InChIKey:PGZISGZFEFJPOZ-UHFFFAOYSA-N
ID: 84701
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.443
InChIKey:RQLRHIMSQLDAGN-UHFFFAOYSA-N
ID: 84702
SMILES:O=CC1C2C(C(C)(C)Oc3c2cc(O)c(C)c3)C(O)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -14.656
InChIKey:NPFKTGBOCGTQCH-UHFFFAOYSA-N
ID: 84703
SMILES:C(C=C(C)C)c1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 84704
SMILES:O=C(CC(C)=CCOc1cc(CCc2ccccc2)cc(O)c1)CC1(C)CCCc2c1ccc(C)c2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.691
CB1 binding score: -13.039
InChIKey:NXWNALAYFRXOPW-UHFFFAOYSA-N
ID: 84705
SMILES:c12c(cc(C(O)=O)cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.929
InChIKey:JHTLXLYXVMDBFT-UHFFFAOYSA-N
ID: 84706
SMILES:C1(C)=CCC(C(=C)C)C(c2c(O)cc(O)cc2C(C(C)C)CCC(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -12.768
InChIKey:WXFLYELLPZKCKA-UHFFFAOYSA-N
ID: 84707
SMILES:C(CC(=CC1CC(C)=CC2c3c(cc(C)cc3O)OC(C)(C)C12)C)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 448.691
CB1 binding score: -13.412
InChIKey:ROLOHCHQKFQBMN-UHFFFAOYSA-N
ID: 84708
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2CC(C(O)(C)C)CCC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -16.775
InChIKey:GYNYTVCKMBORFI-UHFFFAOYSA-N
ID: 84709
SMILES:C(Cc1ccc(O)c(C2C(C(=C)C)CCC(C)=C2)c1O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.556
InChIKey:QCZWXOCGTOVIOA-UHFFFAOYSA-N
ID: 84710
SMILES:CC1=CCC(C(Cc2c(O)c(C)cc(OC)c2)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.156
InChIKey:YRIVZHYOHRUESX-UHFFFAOYSA-N
ID: 84711
SMILES:c12c(cc(O)cc1)OC(C)(C)C1CC(O)C(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.502
InChIKey:BZSSWQQQVIVOHR-UHFFFAOYSA-N
ID: 84712
SMILES:C(C)(C)=CCCC(COC(C)=O)=CCc1cc(O)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -18.349
InChIKey:LKKFKZYYYIFCOI-UHFFFAOYSA-N
ID: 84713
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=C(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.714
InChIKey:KSDRTYDKIHBQRY-UHFFFAOYSA-N
ID: 84714
SMILES:C(CCC)c1c2c(c3c(c1)C=CC(C)(C)O3)OC(C)(C)C1=C2C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.333
InChIKey:LVWXWLVQLCYWAU-UHFFFAOYSA-N