ID: 45382
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)(C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.692
InChIKey:RTQGUJZZCNUWDV-UHFFFAOYSA-N
ID: 45383
SMILES:c1(CCCCC)c(O)c(C(=O)CCc2ccccc2)cc2c1OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.579
InChIKey:YAMKFJHQTJQFAM-UHFFFAOYSA-N
ID: 45384
SMILES:C1=CC(C(=O)O)C(C)(C)Oc2c1c(OC)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -12.917
InChIKey:NKMZFCHPFBFGNR-UHFFFAOYSA-N
ID: 45385
SMILES:c1(C)c(OC)c(OC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.299
InChIKey:PROXGKZRZIXPRR-UHFFFAOYSA-N
ID: 45386
SMILES:C1(CC=C(C)CCC2=C(C)C=CCC2(C)C)(C)Oc2c(O)c(O)cc(C)c2C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -14.119
InChIKey:AMJSCSAEKDEQDC-UHFFFAOYSA-N
ID: 45387
SMILES:c1(O)cc2c(cc1)OC(C)(C)C1CC=C(C)C(O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.057
InChIKey:OGOAPLJUFMNRCL-UHFFFAOYSA-N
ID: 45388
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.385
InChIKey:KCKFCLWTUCSIQS-UHFFFAOYSA-N
ID: 45389
SMILES:c1(O)cc(CCc2cc(O)cc(O)c2)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 380.484
CB1 binding score: -16.849
InChIKey:AAJYWNCTTJUNNH-UHFFFAOYSA-N
ID: 45390
SMILES:C(CC)(OCc1cc(OC)c2c(c1)C1C(C(C)(C)O2)CC=C(C)C1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.638
InChIKey:FYFIDOYUUZNRMD-UHFFFAOYSA-N
ID: 45391
SMILES:C(CC=C(C)C)C(=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 45392
SMILES:CC1CC(C(C)C)(c2c(O)cc(CCCCC)cc2O)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -15.525
InChIKey:JZSIVUQHRXBAFB-UHFFFAOYSA-N
ID: 45393
SMILES:c1(O)cc(CCCCC)cc(O)c1C1CC(CO)=CC(O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.929
InChIKey:LZEMYOYRUUZPIG-UHFFFAOYSA-N
ID: 45394
SMILES:C(C(CCC(=O)C)=C)=CCc1c(O)c2c(c(O)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -16.015
InChIKey:MVPCPBBBUOTNBD-UHFFFAOYSA-N
ID: 45395
SMILES:C(CCCC)c1cc(O)c(C2C(CC=C(COC(=O)C)C)CCC2C(=O)OC)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: Not available
InChIKey:XFDCETDONNQOIA-UHFFFAOYSA-N
ID: 45396
SMILES:C=C(C)C1CC=C(C)CC1c1c(O)c(C(=O)OC)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.871
InChIKey:OUJTUYCAGZDJMD-UHFFFAOYSA-N
ID: 45397
SMILES:C(C)(=CC=CC(c1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)c1)CCCC)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.669
CB1 binding score: -12.9
InChIKey:FQHCVVISSMVWII-UHFFFAOYSA-N
ID: 45398
SMILES:C1(O)C(C)C2=C(C(C)(C)Oc3c(cc(CCCCC)cc3O)C2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.002
InChIKey:OAHQVHVZDWUNLK-UHFFFAOYSA-N
ID: 45399
SMILES:CC(=CCCC(=CCc1c(O)c(C(O)=O)c(CCCCC)c(O)c1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.138
InChIKey:BZHWTNCHQIQETM-UHFFFAOYSA-N
ID: 45400
SMILES:CC(C)(C)Oc1cc(CCCCC)cc2c1C1C(C(C)(O)CCC1C(C)=C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -18.626
InChIKey:IFDGQHLBPVILHT-UHFFFAOYSA-N
ID: 45401
SMILES:C1c2c(cc(CCCCC)c(O)c2)OC(C)(CCC=C(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.54
InChIKey:RDTMBVSHXSIEDF-UHFFFAOYSA-N
ID: 45402
SMILES:Oc1cc(CCCCC)ccc1C1(C)CCC(=O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.269
InChIKey:JPXAVGDSJUFMHF-UHFFFAOYSA-N