ID: 58843
SMILES:O1C2(C)C3C(C(C)(C)Oc4cc(CCC)cc(O)c43)C3OCC(=C)C3C=C2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.335
InChIKey:OPNFIXBVISCMMN-UHFFFAOYSA-N
ID: 58844
SMILES:C(C)CCCc1cc2c3c(c1)OC1(C)CC3C(CC1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.9
InChIKey:IXJXRDCCQRZSDV-UHFFFAOYSA-N
ID: 58845
SMILES:C1(C)C(C)(C)C(c2c(O)cc(CCC)cc2O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -14.889
InChIKey:BQBNXYIOWNQAHB-UHFFFAOYSA-N
ID: 58846
SMILES:c1c(CCCCC)cc(O)c2c1OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 58847
SMILES:C1=C(C)CC2c3c(C)cc(=O)cc(C)c3OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -16.74
InChIKey:RYYSSRDDWOMNKV-UHFFFAOYSA-N
ID: 58848
SMILES:Oc1c2c(c(O)cc1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -16.344
InChIKey:LJGCVIBASUHQIH-UHFFFAOYSA-N
ID: 58849
SMILES:c1(CCCCC)cc(O)c(C2C(C(CO)C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.689
InChIKey:WHIZLAFLNMXXOQ-UHFFFAOYSA-N
ID: 58850
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 58851
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C(=O)O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N
ID: 58852
SMILES:C1(C(=O)O)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -18.209
InChIKey:RAWHNNKBKXBZJY-UHFFFAOYSA-N
ID: 58853
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C=O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.286
InChIKey:NQFUEDHWQJVOKZ-UHFFFAOYSA-N
ID: 58854
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 58855
SMILES:O1c2c(c(O)cc(CCC)c2)C2CC(C(=C)C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.367
InChIKey:DDEOQEHIPHKGCJ-UHFFFAOYSA-N
ID: 58856
SMILES:CC1(C)Oc2cc(CCC(CCCl)O)c(C)c(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.81
CB1 binding score: -13.501
InChIKey:DRJMSLTYVWWOMR-UHFFFAOYSA-N
ID: 58857
SMILES:C(C)Cc1cc(O)c(C2C=C(C(OC)=O)CCC2C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.256
InChIKey:JEFDFKPMESBBRW-UHFFFAOYSA-N
ID: 58858
SMILES:C12C(O)C(O)C(C)CC1c1c(O)c(C(=O)C=C(C)CCC=C(C)C)c(O)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -15.75
InChIKey:PFDWCWMBNUPFJD-UHFFFAOYSA-N
ID: 58859
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C13C(CC2(C=O)C1)C=C(C(C)C)C(=O)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.926
InChIKey:IIZRXORGFRDCLD-UHFFFAOYSA-N
ID: 58860
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 58861
SMILES:COc1cc(O)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.662
InChIKey:MTJFYDONBDGRHM-UHFFFAOYSA-N
ID: 58862
SMILES:CC1(C)CCCC2(C)C(c3c(OC(C)=O)cc(CCCCC)cc3O)OC(C(C(=C)C)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -16.599
InChIKey:JDSAZGNRDFHPKY-UHFFFAOYSA-N
ID: 58863
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC21)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17
InChIKey:CGYHWLVCHKZQHO-UHFFFAOYSA-N