ID: 55483
SMILES:C1(C)=CCC2C(=CC1)C(C)(C)Oc1c2cc(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 324.464
CB1 binding score: -15.253
InChIKey:FWFPWKRYFWNWTL-UHFFFAOYSA-N
ID: 55484
SMILES:C12C(OC(=O)C=CC)(C)C(O)CC(C(C)C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -12.138
InChIKey:ZPPACRJWVVAONO-UHFFFAOYSA-N
ID: 55485
SMILES:Oc1c(C=O)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 55486
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 55487
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -14.974
InChIKey:KJKGUCNPYPONIE-UHFFFAOYSA-N
ID: 55488
SMILES:C1(C(=O)OCC)=CCC2c3c(cc(CCCC)cc3O)OC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.482
InChIKey:PKOBFLZCXNFPPT-UHFFFAOYSA-N
ID: 55489
SMILES:C1(O)C2(O)C(C(CCC(C)C)O)(C)CC=C(CCC=C(C)C)CC23C(=O)c2ccccc2OC13O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: Not available
InChIKey:RVQYBRZRLWYWLY-UHFFFAOYSA-N
ID: 55490
SMILES:C(c1cc2c(c(O)c1)C1=C(C(C)(C)O2)CC(O)C(C)(C)O1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 344.451
CB1 binding score: -16.133
InChIKey:JTSTWYOZFSUKCU-UHFFFAOYSA-N
ID: 55491
SMILES:OC1OC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC1(C)CCC1C(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -14.879
InChIKey:JRRBFTJANXBTFX-UHFFFAOYSA-N
ID: 55492
SMILES:CC(CCC(=C)C(O)(C)C)=CCc1c(O)c(C)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.444
InChIKey:ZWFOZGSKSMCSLT-UHFFFAOYSA-N
ID: 55493
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(O)(C(C)(C)O2)OC(C)(CCC=C(C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -13.759
InChIKey:XPDBZIQLSFDINO-UHFFFAOYSA-N
ID: 55494
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 55495
SMILES:C(C)CCCc1ccc(CC(=O)O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: Not available
InChIKey:MPMSWJAHJUNFTH-UHFFFAOYSA-N
ID: 55496
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 55497
SMILES:CC(=CCc1c(O)cc(CCC)cc1O)CC(O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.972
InChIKey:GVJKXDZANPDGKN-UHFFFAOYSA-N
ID: 55498
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=C(C(C)(C)O1)CC1C(C)(O2)OCC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -11.869
InChIKey:SFMNGMJFEPCBLT-UHFFFAOYSA-N
ID: 55499
SMILES:C(C)CCCc1c(C(O)C(O)C)cc2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.649
InChIKey:AGFXXWDYHGTKKP-UHFFFAOYSA-N
ID: 55500
SMILES:C(=O)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.286
InChIKey:NQFUEDHWQJVOKZ-UHFFFAOYSA-N
ID: 55501
SMILES:C(C)(C)C1=C2C(C)(CCC3(C)C(OC(=O)c4c(CCCCC)cc5c(c4O3)C=CC(C)(C)O5)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.7
CB1 binding score: -14.753
InChIKey:UWRSPBIYHZAOFG-UHFFFAOYSA-N
ID: 55502
SMILES:C12C(=CCC(C)C1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.797
InChIKey:UQOUHXDCXBITSF-UHFFFAOYSA-N
ID: 55503
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N