ID: 59137
SMILES:CC1(C)C(C(O)=O)C(C(=O)C)C2c3c(cc(CCCCC)cc3O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -13.411
InChIKey:JIWGRRHOTHCXFR-UHFFFAOYSA-N
ID: 59138
SMILES:O(C(C)=O)C1C2(C)CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C12O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: Not available
InChIKey:ORKQBCAWNKMOHN-UHFFFAOYSA-N
ID: 59139
SMILES:CC(C)=CC1c2cc(CCCCC)cc(O)c2C2C(C(C)(C)O)OC2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.607
InChIKey:RJMJEATVHBHUFQ-UHFFFAOYSA-N
ID: 59140
SMILES:Oc1cc(CCC)cc2c1C1CC(C)(O2)CCC1C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.624
InChIKey:RRQVSLLVCGRJNI-UHFFFAOYSA-N
ID: 59141
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C2C(C)(OC)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -3.818
InChIKey:NFHWRQGFMSJKAD-UHFFFAOYSA-N
ID: 59142
SMILES:C1(C)=CCCC(C)=CCC(O)(c2c(O)cc(CCCCC)cc2O)C1C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.389
InChIKey:KANGDIQDHXTLAT-UHFFFAOYSA-N
ID: 59143
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C(=O)OC)C3CCOC(=O)C13C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -14.108
InChIKey:IXPGSLZPINXMSE-UHFFFAOYSA-N
ID: 59144
SMILES:c1(O)c2c(cc(CCC(C(=C)C)O)c1)OC(CC=C(C)C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.811
InChIKey:KCIQMSDYKYXDKW-UHFFFAOYSA-N
ID: 59145
SMILES:C1(C(=O)OC)=CC(O)C2(C(C)(C)O)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -13.805
InChIKey:PMTGTJZDELFYPA-UHFFFAOYSA-N
ID: 59146
SMILES:CC12Cc3c(O)cc(CCCCC)cc3OC1(C(C)=C)CC1OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.684
InChIKey:DDHSZYZMGNLXFG-UHFFFAOYSA-N
ID: 59147
SMILES:c1(O)c(C(=O)C(C)C)c2c(c(C(O)C=C(C)C)c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.374
InChIKey:IUZNEEAUGWYKEJ-UHFFFAOYSA-N
ID: 59148
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C3C(C(C)(O)CCC1C(C)(C)O2)CCC3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.302
InChIKey:ULXLBAGGWVKFPK-UHFFFAOYSA-N
ID: 59149
SMILES:Oc1c2c(cc(O)c1CCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -16.742
InChIKey:MTECKHYFYOFDGE-UHFFFAOYSA-N
ID: 59150
SMILES:O(C)c1c2c(cc(OC)c1CC=C(CCC=C(C)C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.288
InChIKey:LOPXOMAKVCWTHW-UHFFFAOYSA-N
ID: 59151
SMILES:c1c(CCc2cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c2)cccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -17.753
InChIKey:VQHVFTSSVQRKBD-UHFFFAOYSA-N
ID: 59152
SMILES:C1(O)CC(c2c(O)cc(CCCCC)cc2O)C(C)(C)C1OC(=O)C(=CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.64
InChIKey:CIXWJJYKJMPQQR-UHFFFAOYSA-N
ID: 59153
SMILES:OC1C(C)C2C(c3c(O)cc(CCCCC)c(OC)c31)OC(C)(C)C1CC=C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -11.71
InChIKey:IRZDCYMCZQXIDV-UHFFFAOYSA-N
ID: 59154
SMILES:C12C=C(C(O)=O)CCC1C(C)(C)Oc1c2cc(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids
MW: 410.554
CB1 binding score: -15.656
InChIKey:RINHGQGNCGTAKO-UHFFFAOYSA-N
ID: 59155
SMILES:c1c(CCCCC)cc2c(c1O)C1C3C(C=C1)CC(O)C(O)(C)C3CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.766
InChIKey:FLUHGJNNSNXIOL-UHFFFAOYSA-N
ID: 59156
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1CC=C(C)C(O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.995
InChIKey:IPXCZYCBPDJMFH-UHFFFAOYSA-N
ID: 59157
SMILES:c12c(OC)c(O)c(CCCCC)cc1OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.504
InChIKey:MJOWSFGTIIAADH-UHFFFAOYSA-N