ID: 123481
SMILES:c1(OC)c(C2CC(C)=CC(c3c(O)cc(CCC)cc3)C3C2(C)CCCC3(C)C)cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -13.775
InChIKey:ILWUGFMKNWVGKO-UHFFFAOYSA-N
ID: 123482
SMILES:c1c(C2c3cc(O)c4c(c3OC)OC(C)(C)C3CCC(C)(O3)C42)cccc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -13.583
InChIKey:FIAJVTJIHJRUEW-UHFFFAOYSA-N
ID: 123483
SMILES:c1c(CCC)cc(O)c2c1OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 123484
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.855
InChIKey:KBTNQOVTNZTJGJ-UHFFFAOYSA-N
ID: 123485
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CCCCCCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.685
CB1 binding score: -20.79
InChIKey:DCMUJCFANMFBTN-UHFFFAOYSA-N
ID: 123486
SMILES:CC(O)(CC(=O)C=C(CCCC(=O)C)C)C1CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -12.701
InChIKey:QFURHJQEKYDDGS-UHFFFAOYSA-N
ID: 123487
SMILES:C1C(O)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.086
InChIKey:ISGXHOAOFJBNGZ-UHFFFAOYSA-N
ID: 123488
SMILES:O=CC(c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.672
InChIKey:NOCANYORFJKYIY-UHFFFAOYSA-N
ID: 123489
SMILES:c1c(C(C)C)cc(OC)c2c1OC(CCC=C(CCC=C(C)C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.92
InChIKey:SJBPKFQYKGUKED-UHFFFAOYSA-N
ID: 123490
SMILES:C(C)(C(OC)=O)=C1CCC2(C)OC2CCC2(C)C=CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.088
InChIKey:ATWAUOFZMCAPDQ-UHFFFAOYSA-N
ID: 123491
SMILES:C1(C)(O)C(OC(CCC)=O)C(OC(C(C)=CC)=O)C(C(=C)C)C(c2c(O)cc(CCCCC)cc2OC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.702
CB1 binding score: -14.033
InChIKey:KAOIHZAMBAZGTI-UHFFFAOYSA-N
ID: 123492
SMILES:C=CC(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C(O)=O)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: Not available
InChIKey:FARVXANTFFUEIP-UHFFFAOYSA-N
ID: 123493
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)C1=C2C(Br)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.364
CB1 binding score: -14.278
InChIKey:AGRVQBWYYXGPQW-UHFFFAOYSA-N
ID: 123494
SMILES:c1(C)c(C2C=C(C)CCC2C(=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.789
InChIKey:NUKHFQFTDCRHSF-UHFFFAOYSA-N
ID: 123495
SMILES:C(CCCC)c1ccc(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.615
InChIKey:CRXGOYTUACLVFE-UHFFFAOYSA-N
ID: 123496
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 123497
SMILES:C(CC)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 123498
SMILES:CCCCCc1c(C(O)=O)c(O)c(C2C=C(O)CC(O)C2(CCC=C(C)C)C)c(I)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.454
CB1 binding score: -15.329
InChIKey:OUSGAJDUKFSMLV-UHFFFAOYSA-N
ID: 123499
SMILES:O1C(=O)c2c(O)cc(CCCCC)cc2OC1(CCC=C(C)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.571
InChIKey:CYTYLUSYKFHEIM-UHFFFAOYSA-N
ID: 123500
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 123501
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N