ID: 107689
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(CCC=C(C)C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.598
InChIKey:LLENDDNLPXXHPV-UHFFFAOYSA-N
ID: 107690
SMILES:CC(C)=C1CC(O)C(C)=CC1c1cc(CCCC)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.083
InChIKey:IFGIAHBLKUKIJI-UHFFFAOYSA-N
ID: 107691
SMILES:C1(C)(O)CCC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 107692
SMILES:C1(C)=CC2C(C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2=O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.799
InChIKey:BHECKYGGMBPCMH-UHFFFAOYSA-N
ID: 107693
SMILES:c1c(OC)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.996
InChIKey:YOJXVRSBFALZPJ-UHFFFAOYSA-N
ID: 107694
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C(C)C)C=C(CCC(C(C)=C)=C1)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.588
InChIKey:WEHDFCGVHBOSIC-UHFFFAOYSA-N
ID: 107695
SMILES:c1(C2C(C(C)=C)CCC(C)=C2)c(O)cc(C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.899
InChIKey:JYURTPNPFFXLFB-UHFFFAOYSA-N
ID: 107696
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 107697
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CCC(=C)C1C(=O)C=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -11.872
InChIKey:XONMVJZNGFMDGZ-UHFFFAOYSA-N
ID: 107698
SMILES:C12(C(O)=C(C(c3cc(OC)c(O)cc3)CC(=O)O)C(=O)CC1C)Oc1c(C)cc3c(c1C2=O)C1C(C(C)(C)O3)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.669
CB1 binding score: -13.574
InChIKey:AZXLXPAURUDMRL-UHFFFAOYSA-N
ID: 107699
SMILES:Fc1c2c(O)cc(O)c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.323
CB1 binding score: -14.792
InChIKey:CLHLJQONLQGXNU-UHFFFAOYSA-N
ID: 107700
SMILES:C12CCC(C)CC1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 107701
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 107702
SMILES:C12C(CCC(C)=C1)C(C)(C)Oc1cc(CCCCC)cc(OC(=O)C)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 107703
SMILES:C1C2C(c3c(cc(CCCCC)cc3OC)O1)C(C(C)=C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.824
InChIKey:WTCHXYCPEAJXEC-UHFFFAOYSA-N
ID: 107704
SMILES:C(=C(C)C)CCC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 107705
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 107706
SMILES:Oc1c(O)c2c(c(C)c1)C1C(CC2)C(C)(C)OC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -11.745
InChIKey:ZVOMKXITPHEUDR-UHFFFAOYSA-N
ID: 107707
SMILES:C(C(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 107708
SMILES:C1(C)(CCC=C(C)C)C2CC(=O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.317
InChIKey:KMWYKUUZHLOJAK-UHFFFAOYSA-N
ID: 107709
SMILES:C(CCCCc1cc(O)c2c(c1)OC(CO)(C)C1C2CCC(O)(C)C1=O)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -14.123
InChIKey:UUFYHLMGKJLHIF-UHFFFAOYSA-N