ID: 57688
SMILES:CC1(CC)Oc2c(c(OC)cc(CO)c2)C2C=C(COC(=O)C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.258
InChIKey:ONSLGDGADWXJHD-UHFFFAOYSA-N
ID: 57689
SMILES:c1(O)cc(CCCCC)ccc1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 57690
SMILES:CCC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -18.657
InChIKey:FDLOCOCZVCOHMB-UHFFFAOYSA-N
ID: 57691
SMILES:Oc1c(O)c(CCCCC)cc2c1C1C(CCC(CO)=C1)C(CCC(C(C)(O)C)O)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.6
CB1 binding score: -16.521
InChIKey:NVZNIMGGQTXMMJ-UHFFFAOYSA-N
ID: 57692
SMILES:c1(O)c(CCCC)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.082
InChIKey:PBMDVMXHDJRQRK-UHFFFAOYSA-N
ID: 57693
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(CCC=C(C)C)(C)C3CC1C(C)(CC3C=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -17.026
InChIKey:MTBPMHJNGCWGHW-UHFFFAOYSA-N
ID: 57694
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 57695
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(CO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.196
InChIKey:HQWTZGLRGCSGTB-UHFFFAOYSA-N
ID: 57696
SMILES:CCCC(c1c(O)c2c(cc1O)OC(C)(C)C1CC=C(C)CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.953
InChIKey:CERMHWOVRJXIQI-UHFFFAOYSA-N
ID: 57697
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 57698
SMILES:C1=C(C)CCC(C(C)=C)Cc2c(C)c(O)c(=O)cc(CCCCC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.433
InChIKey:JPJJNMJIEOASMF-UHFFFAOYSA-N
ID: 57699
SMILES:C1(=O)C(C)CC2c3c(c(CCCCC)cc(O)c31)OC(C)(C)C1CC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: Not available
InChIKey:JXEKNCVEUJQCNS-UHFFFAOYSA-N
ID: 57700
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(=C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.502
InChIKey:HDNJNVPZXVJOMB-UHFFFAOYSA-N
ID: 57701
SMILES:C1C23CC(O)C(C(C)(C)C2CCC1C)Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.616
InChIKey:KHGLQECAIZGGQT-UHFFFAOYSA-N
ID: 57702
SMILES:O1C(C)(C)C2C(c3c(O)c4c(cc3O)OC(C)(C)C(CCC(C)=CC2)C4)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.998
InChIKey:MZPDACOKGWSDHY-UHFFFAOYSA-N
ID: 57703
SMILES:C(C)CCCc1c(C(O)=O)c(O)c(CC=C(CCC(C(C)C)=C)C(=O)O)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -12.53
InChIKey:DQHHIQACFNJAGT-UHFFFAOYSA-N
ID: 57704
SMILES:Oc1cc(O)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.561
InChIKey:RRHAEGQFRQNVHT-UHFFFAOYSA-N
ID: 57705
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -19.296
InChIKey:GEMPDHCIWOATES-UHFFFAOYSA-N
ID: 57706
SMILES:C(CCC(=CCc1c(O)c(C(=O)O)c(CCC)cc1O)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 57707
SMILES:C(CCCCCCC(=O)C)Cc1cc2c(cc1C)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -15.064
InChIKey:OFBMKYDNAJXEMW-UHFFFAOYSA-N
ID: 57708
SMILES:C1CC(C(C)CO)C(c2c(O)ccc(CCCCC)c2)C1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.29
InChIKey:NNWFZBDNBQKFKP-UHFFFAOYSA-N