ID: 39649
SMILES:C(O)C1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(CO)(C)OC2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.448
CB1 binding score: -13.401
InChIKey:HVWJHBJJJRRGSI-UHFFFAOYSA-N
ID: 39650
SMILES:CC1(C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.02
InChIKey:XVDPKZZJQYLKAD-UHFFFAOYSA-N
ID: 39651
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 39652
SMILES:O1c2ccc(CCCCC)cc2C2C1CCC(C(C)=C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -14.5
InChIKey:VHMQREDWNCSAAV-UHFFFAOYSA-N
ID: 39653
SMILES:C1C2C(CC=C1C)C(C)(C)Oc1cc(C)c(O)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.091
InChIKey:DENJPBAXNZGHTK-UHFFFAOYSA-N
ID: 39654
SMILES:C1(=O)C2C(CCC=C(COC(CCc3ccc(O)c(O)c3)=O)C)(C)C1C(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -15.863
InChIKey:JEGUHKJWUAAWSD-UHFFFAOYSA-N
ID: 39655
SMILES:c1c(CC(C)C)c2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.248
InChIKey:INPPYFJKDVLSRW-UHFFFAOYSA-N
ID: 39656
SMILES:C12(O)C(c3c(O)cc(CCCCC)cc31)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -16.078
InChIKey:YGRKLYVFBMIMDG-UHFFFAOYSA-N
ID: 39657
SMILES:C1(C(C)(O)C)C(c2c(O)cc(CCCCCBr)cc2O)C(O)C2(C)C3CC(C(=O)C2)OC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 511.453
CB1 binding score: -15.175
InChIKey:KLPVYNPBEZTQKO-UHFFFAOYSA-N
ID: 39658
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 39659
SMILES:C(C(C)(O)CCC=C(C)C)=Cc1c(CCCCC)cc(O)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.502
InChIKey:UIKUQLAAVGEYFL-UHFFFAOYSA-N
ID: 39660
SMILES:C(CCC)Cc1cc(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: 39661
SMILES:Cc1cc2c(c(OC)c1)C1=C(C(C)(C)O2)CCC(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.691
InChIKey:WKEHOPQEBGGNPS-UHFFFAOYSA-N
ID: 39662
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1(O2)C=CC(C)CC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.363
InChIKey:RQWRJEBJAGLVAP-UHFFFAOYSA-N
ID: 39663
SMILES:C(CCC=C(C)C)(=CCc1c(O)cc(CCCCC)c(C=O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -19.069
InChIKey:ROXSKQXJGMFFHX-UHFFFAOYSA-N
ID: 39664
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 39665
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C(=O)O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 39666
SMILES:Oc1cc(O)c(CC=C(CCC=C(C)C)C)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 39667
SMILES:C1=Cc2c(c(C(O)=O)cc(CCCCC)c2)OC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.282
InChIKey:NNARCEIBAUQQFA-UHFFFAOYSA-N
ID: 39668
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.749
InChIKey:GIBGCECZZOVLMK-UHFFFAOYSA-N
ID: 39669
SMILES:CC1(C)C2CCC(C)=CCc3c(cc(CCCC)cc3O)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.588
InChIKey:YNARSHBHVWJGKH-UHFFFAOYSA-N