ID: 117727
SMILES:C(Cc1cc(Oc2c(CC=C(C)C)c(O)c(CC=C(C)C)c(O)c2)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.83
CB1 binding score: -16.502
InChIKey:QQQDCWZEBNVMQM-UHFFFAOYSA-N
ID: 117728
SMILES:CC12Oc3c(c(O)cc(C)c3)C3C1(CCC=C(C)CO)C2CC=C3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.254
InChIKey:HCFVJUSCKPJPIE-UHFFFAOYSA-N
ID: 117729
SMILES:CC(=CC1c2c(O)cc(CCC)cc2OC1(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.584
InChIKey:QBJCBYIDNOPVRF-UHFFFAOYSA-N
ID: 117730
SMILES:C1=C(C)CC2c3c(cc(C)cc3)OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.589
InChIKey:ILPMEUDSBVWXIW-UHFFFAOYSA-N
ID: 117731
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.839
InChIKey:UAYYOKYCPZUMPM-UHFFFAOYSA-N
ID: 117732
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 117733
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C(OC)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.713
InChIKey:JGIGFQOJOHJUHS-UHFFFAOYSA-N
ID: 117734
SMILES:c1(OC)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.077
InChIKey:ZIKXLTXYADKTKX-UHFFFAOYSA-N
ID: 117735
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(=C)CCC3C(C)(C)CC13)C(=O)O2)C(=CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -14.902
InChIKey:UBTYVSOKZOLPMY-UHFFFAOYSA-N
ID: 117736
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(CCC=C(C)C)C(=O)CC1C(=C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.61
CB1 binding score: -17.291
InChIKey:LQGVKKVEMGUHCW-UHFFFAOYSA-N
ID: 117737
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2ccc(C(O)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.929
InChIKey:JHTLXLYXVMDBFT-UHFFFAOYSA-N
ID: 117738
SMILES:O(CC(=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 346.511
CB1 binding score: -16.088
InChIKey:LFOROYRZDMRZLT-UHFFFAOYSA-N
ID: 117739
SMILES:Cc1c(C2C=C(C)CCC2C(C)=C)c(O)c(C(=O)CC(C)C)c(O)c1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.428
InChIKey:GYIKHYQXZPCMEL-UHFFFAOYSA-N
ID: 117740
SMILES:CC1CC=C2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.552
InChIKey:JOOJPAOQGSLKJI-UHFFFAOYSA-N
ID: 117741
SMILES:C(C=C(C)CC=CC(O)(C)C)c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.334
InChIKey:AFSHLXLGQFRFPZ-UHFFFAOYSA-N
ID: 117742
SMILES:C1(C)(C)OCC2(C)Oc3c(c(O)cc(CCCCC)c3)CC2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.889
InChIKey:OFBWICRXDIIUFJ-UHFFFAOYSA-N
ID: 117743
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.686
InChIKey:UZIVICVRBBCBHK-UHFFFAOYSA-N
ID: 117744
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCC)cc2OC)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.854
InChIKey:OZYYEDPTJXVZJQ-UHFFFAOYSA-N
ID: 117745
SMILES:c12c(O)ccc(O)c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.988
InChIKey:FDECQIAQAVZRFF-UHFFFAOYSA-N
ID: 117746
SMILES:CC1(C)Oc2cc(CCCCCCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 117747
SMILES:c1(O)c2c(c(OC)cc1CCCCC)OC(C)(C)C1CCC(C)C(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.332
InChIKey:PUSPKASSWQGUQF-UHFFFAOYSA-N