ID: 77869
SMILES:C1C(CO)(C)Oc2c3c(cc(CCCCC)c2)OC(C)(C)C2C1C3C(O)(CCC(C)=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.084
InChIKey:VIRZPOOWWMYFNM-UHFFFAOYSA-N
ID: 77870
SMILES:C(CCCc1cc(C2C=C(C)CCC2C(C)(C)O)c(OC)cc1)C(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.132
InChIKey:KZZOITDYTXUNIF-UHFFFAOYSA-N
ID: 77871
SMILES:C1(CC(C)C)c2c(O)cc(CCCCC)cc2OC(CCC=C(C)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -15.948
InChIKey:OUIAWTCSXQETFN-UHFFFAOYSA-N
ID: 77872
SMILES:C1(C(C)=C)C[CH]C(=C)CC1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 285.407
CB1 binding score: -15.389
InChIKey:GXAPRNHKDAWOAO-UHFFFAOYSA-N
ID: 77873
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2CC3(C)CC(OC)C(O)(C32)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -12.54
InChIKey:MVFMGQWTZSIKTM-UHFFFAOYSA-N
ID: 77874
SMILES:C1(=O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.281
InChIKey:XNTMOCUAPBGYEC-UHFFFAOYSA-N
ID: 77875
SMILES:OC(C)(C)c1cc(Oc2cc(O)c(C(O)C(CC)C(Cc3cc(CC=C)ccc3O)=O)cc2O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 656.816
CB1 binding score: -11.478
InChIKey:GZZYJMQGPWVBHK-UHFFFAOYSA-N
ID: 77876
SMILES:C1=C(C)CCC(O)C(C)(C)Oc2cc(C(C)C)cc(OC)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.184
InChIKey:BXQOGRRKGWTNAV-UHFFFAOYSA-N
ID: 77877
SMILES:c1c2c(c(CCCCCC)cc1O)OC(C)(C)C1=C2C(=O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.728
InChIKey:SUYGSAHHEQPGQG-UHFFFAOYSA-N
ID: 77878
SMILES:c1c(CCC)cc(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -20.718
InChIKey:RGRVRWPXYHVOQC-UHFFFAOYSA-N
ID: 77879
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 77880
SMILES:O=CC(C)=CCCC1=CC(c2c(O)cc(CCCC)cc2O)OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -17.388
InChIKey:DWMUQJWLJSZFFR-UHFFFAOYSA-N
ID: 77881
SMILES:C1CC(C)CC(c2c(O)cc(CCCCC)cc2)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.502
CB1 binding score: -17.372
InChIKey:ACOLREACBPQROW-UHFFFAOYSA-N
ID: 77882
SMILES:C(CCCc1ccc(O)c(CC=C(CCC=C(C)C)C)c1)C1=CCOC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -14.308
InChIKey:RYUIXCZCNLFSMP-UHFFFAOYSA-N
ID: 77883
SMILES:C(C=C(C)C)CC1(C)Oc2cc(CCCCC)ccc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.334
InChIKey:GKTLMTLABYYGES-UHFFFAOYSA-N
ID: 77884
SMILES:C12(c3c(cc(CCCCC)cc3O)OC(C)(C)C1CC=C(C)C)C1OC1(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -15.652
InChIKey:LEDHDAQIAMVRLR-UHFFFAOYSA-N
ID: 77885
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2CCC(C(=O)O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.63
InChIKey:XKJHMRMUZXJASC-UHFFFAOYSA-N
ID: 77886
SMILES:C=C(c1cc(O)c2c(c1C)CCC1C(=O)OC(C)(C)C1C2OC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.044
InChIKey:XJABOULZBFEZJY-UHFFFAOYSA-N
ID: 77887
SMILES:C1=C(C)CCC2C1C(C)(C)Oc1c2c(OC)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.436
InChIKey:DBMLODSLFKHFOD-UHFFFAOYSA-N
ID: 77888
SMILES:CC1(C)C2C(C)(CCC1)Oc1c(cc(CCCCC)cc1O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.298
InChIKey:BXDONIIVZXTLCN-UHFFFAOYSA-N
ID: 77889
SMILES:Oc1c(O)cc(C(C(OC)=O)c2cc3c(c(O)c2)C2C(C(C)(C)O3)CC3C4COC(C)(C)C4CCC3(C)C2OC(=O)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 608.728
CB1 binding score: -15.929
InChIKey:WFBFTMYLCADCGF-UHFFFAOYSA-N