ID: 29548
SMILES:OC1C(C)(C)C2CC(O)C3(C)Oc4c(c(O)c(C(=O)OC)c(CCCCC)c4)C3CC2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -15.568
InChIKey:MZKMGWGSNAKLGS-UHFFFAOYSA-N
ID: 29549
SMILES:C1C(O)(C)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 29550
SMILES:Cc1ccc2c(c1)-c1c(c(C(=O)O)cc(CCCCC)c1)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -15.513
InChIKey:PTWLVEHFAPRXSD-UHFFFAOYSA-N
ID: 29551
SMILES:c12cc(CCCCC)cc(OC(C)(C3CC4(O)C(C)(O4)CCC=C(C)C)C3O)c1OCO2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -16.045
InChIKey:FIICIHPIPIMXCH-UHFFFAOYSA-N
ID: 29552
SMILES:C12(C)C(O)CCC3(C1C(c1c(O)cc(CCCCC)cc1OC(=O)C)O3)C(C)C(=CC(=O)OC)OC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.631
CB1 binding score: -11.335
InChIKey:GVWOPBFKSIKDNK-UHFFFAOYSA-N
ID: 29553
SMILES:Oc1c(CC=C(C)CCC(C(C)(OC)C)O)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.526
CB1 binding score: -18.01
InChIKey:ICWXSTTXJKJXGR-UHFFFAOYSA-N
ID: 29554
SMILES:C(=CCO)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.264
InChIKey:LTOTURCVANTSBG-UHFFFAOYSA-N
ID: 29555
SMILES:Oc1cc(CC)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 29556
SMILES:c1(O)cc(CCCCC)cc2c1C1=C(CC(C)C)C(C)(C)C3OC3C1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: Not available
InChIKey:MJUPSYUYTMTDCQ-UHFFFAOYSA-N
ID: 29557
SMILES:C1(CCC=C(C)C)(C)C=Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 29558
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 29559
SMILES:Oc1c(C(c2cc(C)cc(O)c2)C=CC(C)CC2OC2(C)C=CC(CCCC)C(O)=O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 644.849
CB1 binding score: -14.479
InChIKey:BBJDKTHOOSGBMD-UHFFFAOYSA-N
ID: 29560
SMILES:CC1(C)CCCC2(C)Oc3c(c(O)cc(CCCCCC)c3)C3C21CC=C3CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.087
InChIKey:XCFCXFSYESGLIV-UHFFFAOYSA-N
ID: 29561
SMILES:C1C(c2c(O)cc(CCCC)cc2O)C(C(=C)C)C2C=C(CCC(=C1C)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.577
InChIKey:UQGKMKCGHJLZKE-UHFFFAOYSA-N
ID: 29562
SMILES:c1(O)cc(C)cc2c1C(C)(C)C1(CC(C)=C(C=O)C1O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -12.887
InChIKey:JNNBAFBZPCRSLN-UHFFFAOYSA-N
ID: 29563
SMILES:C(C)CCCc1cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.365
InChIKey:TVLUJXRPTYGDHM-UHFFFAOYSA-N
ID: 29564
SMILES:C(C1CC=C(C)CC1c1c(O)cc(CCCCC#C)cc1)C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.519
InChIKey:KEXUXOHHDXWEBG-UHFFFAOYSA-N
ID: 29565
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 29566
SMILES:c12c(O)cc(CCCCC)cc1OC(C(O)(C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.942
InChIKey:PRKDRANYBPHDBW-UHFFFAOYSA-N
ID: 29567
SMILES:O=C1C(=O)C2(c3c(cc(CCCCC)cc3O)O1)CC=C(C)C2CC=C(C)CCC1C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -16.037
InChIKey:QVHWNZDGWPDVMS-UHFFFAOYSA-N
ID: 29568
SMILES:C(CCC)CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -15.006
InChIKey:RRDUNPIQSIAVJG-UHFFFAOYSA-N