ID: 64786
SMILES:Oc1cc(CCC)cc(-c2c(O)cc(O)c3c2OC(C)(C)C2CCC(C)=CC3)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -16.763
InChIKey:SDQFSZGADRZNBN-UHFFFAOYSA-N
ID: 64787
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(COC(CCc2ccc(O)cc2)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.629
CB1 binding score: -16.109
InChIKey:LBNAXUDPWCXPIN-UHFFFAOYSA-N
ID: 64788
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC(=O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 64789
SMILES:C1(=C)C2C(C)(CCC1CC(O)(C)C)C1C(C)(CC2)Oc2cc(CCC)cc(O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -17.587
InChIKey:BUCIVSSISGBCHZ-UHFFFAOYSA-N
ID: 64790
SMILES:c1ccc(OC)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 64791
SMILES:C(C)(C)C1C2C(C(=O)O1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.036
InChIKey:WIRGPRKBMZCUFP-UHFFFAOYSA-N
ID: 64792
SMILES:Oc1cc(CCCCC)cc(O)c1C1C(OC2C(C(C)C)CCC(C)C2)Oc2c(cc(O)cc2C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -14.831
InChIKey:FZSIUJCHQDCNRW-UHFFFAOYSA-N
ID: 64793
SMILES:C(CCc1c(C(=O)O)cc(CCCCC)cc1O)C(C)(O)C
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 308.418
CB1 binding score: -14.616
InChIKey:NKYFWPURNVKBRC-UHFFFAOYSA-N
ID: 64794
SMILES:C1CCC(=C)C2(O)C(=O)c3c(CCCCC)cc(O)cc3OC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -11.756
InChIKey:NIJUPBFCLHDJIX-UHFFFAOYSA-N
ID: 64795
SMILES:CC1(O)C=CCc2c(cc(CCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -16.578
InChIKey:IGBDONCZCZJGER-UHFFFAOYSA-N
ID: 64796
SMILES:C1(C=C(C)C)CC23C4Oc5c(c(O)cc(CCCCC)c5)OC2(C)CC3OC4C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.504
InChIKey:VOFQPMCEAITYOA-UHFFFAOYSA-N
ID: 64797
SMILES:C(c1cc(O)c(CC=C(C)CCC(OCC)C=C(CC2C(C(C)=C)CCC2(C)O)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.775
CB1 binding score: -13.998
InChIKey:ISOWQZFWEZEZOW-UHFFFAOYSA-N
ID: 64798
SMILES:C12(c3c(cc(CCCCC)cc3O)OC1(C)C)C1C(CO2)C2C(C)(C(=O)C3=C(C2=O)C(C=C(C)C)O3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.666
CB1 binding score: -13.687
InChIKey:CXOMOALGHNFPKU-UHFFFAOYSA-N
ID: 64799
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.54
InChIKey:QHRGZMCKZLOXFN-UHFFFAOYSA-N
ID: 64800
SMILES:C1CC(C)C2C1c1c(O)cc(CCCCC)c(OC(=O)C=Cc3ccccc3)c1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -13.99
InChIKey:NEWNQZPCVSBKSY-UHFFFAOYSA-N
ID: 64801
SMILES:C=C(C)C1C(c2c(O)ccc(OC)c2)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.401
InChIKey:YRXZLRWBEYIBHE-UHFFFAOYSA-N
ID: 64802
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -18.039
InChIKey:GRVCUBBHEHRQOC-UHFFFAOYSA-N
ID: 64803
SMILES:Oc1c(C(C(C)CC)=O)c2c(c(C(O)=O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -15.578
InChIKey:WXCLVXITZZMNMU-UHFFFAOYSA-N
ID: 64804
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 64805
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(O)cc(CC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 64806
SMILES:CC1(C)C2C(OC(C)=O)C=C(C)C3C21c1c(cc(CCCCC)cc1O)OC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -15.287
InChIKey:FDWSCMYIYSIERA-UHFFFAOYSA-N