ID: 54664
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc4c3C1(O4)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.121
InChIKey:LTJOGKFFEMLRFA-UHFFFAOYSA-N
ID: 54665
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)C(OC2OC(CO)C(O)C(O)C2O)C1)CCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.717
CB1 binding score: -14.783
InChIKey:GFBZXOYFTBRYQQ-UHFFFAOYSA-N
ID: 54666
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(O)cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 54667
SMILES:C1CC(C)=CC(c2c(O)cc(CCC)cc2O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 54668
SMILES:C1=C2C(CC=C1C)C(C)(C)Oc1cc(C)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -16.502
InChIKey:OPBIZCVEXHJOBH-UHFFFAOYSA-N
ID: 54669
SMILES:CC(C)=CCCC(=CCc1c(OC)cc2c(c1OC)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.29
InChIKey:RFSHAWLPNBNOSU-UHFFFAOYSA-N
ID: 54670
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 54671
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C(O)CCCC)c(C=O)c(c32)OC1c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.576
CB1 binding score: -13.324
InChIKey:QWXNRLMLXWBGRD-UHFFFAOYSA-N
ID: 54672
SMILES:C(C)c1ccc(O)c(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -17.818
InChIKey:RADTXAUITHHEAT-UHFFFAOYSA-N
ID: 54673
SMILES:C1=CC(C)(O)CCC2C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.339
InChIKey:RHPHKKMJIXDUMO-UHFFFAOYSA-N
ID: 54674
SMILES:C1(=O)CC(C)(C)Oc2c(c(O)c(CCCC)c(O)c2)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.842
InChIKey:PVNCDEFWOGANAK-UHFFFAOYSA-N
ID: 54675
SMILES:O1C(C)(C)C2C(C)(CC(O)C(O)C2(C)C)C12Oc1c(c(O)cc(CCCCC)c1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -14.941
InChIKey:OFDYZVDSZQCJNF-UHFFFAOYSA-N
ID: 54676
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1(O)C(=C(C)C(=O)C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.992
InChIKey:ZCANRQKTSWYYJE-UHFFFAOYSA-N
ID: 54677
SMILES:C(C1C23C(c4c(OC)cc(CCCCC)cc4O2)OC(C)(CC1)C=C3)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.802
InChIKey:YEAOYTISYZIBSX-UHFFFAOYSA-N
ID: 54678
SMILES:C1(C)=CC2c3c(O)cc(O)cc3OC2(C)OC1CC1OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -15.463
InChIKey:HJNFMNIBNATOFN-UHFFFAOYSA-N
ID: 54679
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54680
SMILES:COc1c(O)c2c(cc1CCCCC)OC(C)(C)C(OC(C=C(C)C=C)=O)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.374
InChIKey:COIZFPVKKFVDQB-UHFFFAOYSA-N
ID: 54681
SMILES:CC(C)=CCOc1cc(CCCCC)cc(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -17.314
InChIKey:BIQPDOIGNXBVNT-UHFFFAOYSA-N
ID: 54682
SMILES:c1(C(=O)OCC)c(C)c2c(c(OC)c1)C=CC(C)(CCC1(C)CCC(O)C(C)(C)O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -14.431
InChIKey:IGVTXVMRDWZQSW-UHFFFAOYSA-N
ID: 54683
SMILES:C12c3c(c(C(O)=O)cc(CCCCC)c3)OC(C)(C)C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.457
InChIKey:BVAXYGOQYDIPQI-UHFFFAOYSA-N
ID: 54684
SMILES:C(CCC)c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N