ID: 79843
SMILES:C(C)CCCc1cc2c(c(O)c1)C1(O)C(=O)C(C)(C3(C)C(CC1)C1(C)C(CC3)O1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -11.617
InChIKey:RDCCVWYXCYLPEA-UHFFFAOYSA-N
ID: 79844
SMILES:c12cc(CCCC)ccc1OC1(C)CC2C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.438
InChIKey:KNBYZWYRBKVNCM-UHFFFAOYSA-N
ID: 79845
SMILES:CC1(OO)CC(c2c(O)cc(CCCCC)cc2)C(C(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -15.553
InChIKey:CNQZNNCUOXNXHF-UHFFFAOYSA-N
ID: 79846
SMILES:c1(C2OC(=O)C=C(C)C2)c(O)cc(CCCCC)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.648
InChIKey:DYUDYWXSJHBLAK-UHFFFAOYSA-N
ID: 79847
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C1C2(C)CCC3C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.236
InChIKey:PDFGNLNCTAXGAH-UHFFFAOYSA-N
ID: 79848
SMILES:C(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)(CCC=C(CCC=C(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 79849
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.334
InChIKey:LTJOTHGPJVLRQN-UHFFFAOYSA-N
ID: 79850
SMILES:C(c1cc2c(c(O)c1C(=O)CC(C)C)C=CC(C)(CCC=C(C)C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.411
InChIKey:UYLHDZHWGQIMGE-UHFFFAOYSA-N
ID: 79851
SMILES:C1(C)(O)CCC(C(C)C)C2c3c(O)cc(CCC)cc3OC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.729
InChIKey:QAMUCWBQNARAQQ-UHFFFAOYSA-N
ID: 79852
SMILES:C(C(=CCc1c(OC)cc(CCCCC)c(C(O)=O)c1O)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -19.037
InChIKey:VAFRUJRAAHLCFZ-UHFFFAOYSA-N
ID: 79853
SMILES:C12CCC(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.656
InChIKey:HCJBMFVORPGQMJ-UHFFFAOYSA-N
ID: 79854
SMILES:C(=C(C)C)CCC(C)=CCCC(C)=CCc1c(O)cc(CCc2ccc(O)c(OC)c2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -17.369
InChIKey:TUVKGVLLKSSXDB-UHFFFAOYSA-N
ID: 79855
SMILES:C(OC)(CC1(O)c2c(cc(C)cc2O)OC1(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 266.337
CB1 binding score: -13.82
InChIKey:FFFWWARNFFSIDQ-UHFFFAOYSA-N
ID: 79856
SMILES:C(O)C1=CC2C(C(C)(C)Oc3cc(CCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 79857
SMILES:Cc1cc2c(c(O)c1C(CC(=CCCC(=CC)C)C)O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -14.254
InChIKey:BHYYXHLKWFQMNW-UHFFFAOYSA-N
ID: 79858
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C(OC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.314
InChIKey:KIPOYGDBLDUBRH-UHFFFAOYSA-N
ID: 79859
SMILES:C(C=C(C)C)CC(C)=CC(O)C1COc2cc(CCCCC)ccc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.299
InChIKey:ZXYMGEIAPFYZEE-UHFFFAOYSA-N
ID: 79860
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 79861
SMILES:O=C(Oc1c(OC(=O)C)c2c(cc1C)OC1(C(C)(C)O1)CCC(C)=C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -16.051
InChIKey:FAMSCMHSUMCOBA-UHFFFAOYSA-N
ID: 79862
SMILES:CC1=C2C(c3c(O)c(C(OC)=O)c(CCC)cc3O)C(C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.471
InChIKey:GIJCHLPRFXYJIL-UHFFFAOYSA-N
ID: 79863
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N