ID: 29758
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3C1(C)C(O)CCC3(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.67
InChIKey:MQZRJBFWJYSLAS-UHFFFAOYSA-N
ID: 29759
SMILES:O=CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 29760
SMILES:C(CCc1cc2c(c(O)c1)C=CC(CCC=C(C)C)(C)O2)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.269
InChIKey:IZDCDFGGSRCPGZ-UHFFFAOYSA-N
ID: 29761
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(CCC=C(CO)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.346
InChIKey:POPBLMRNLSTLOC-UHFFFAOYSA-N
ID: 29762
SMILES:C(CC(CCCC1(C)C(O)Cc2c(cc(C)cc2O)O1)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.02
InChIKey:RJPFOAKSSZMZDF-UHFFFAOYSA-N
ID: 29763
SMILES:c1(O)c2c(cc(C(O)(C)CCCC=C)c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.425
InChIKey:QPDPHIRQGGJIJQ-UHFFFAOYSA-N
ID: 29764
SMILES:C1=C(C)C2C(C1)C(C)(C)Oc1c2c(O)cc2c1oc(O)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.327
CB1 binding score: -14.729
InChIKey:GZEISOUZNNGMGL-UHFFFAOYSA-N
ID: 29765
SMILES:CC12CCC(C)(O)C(C)=C1c1c(cc(CCCCCC)cc1O)OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.663
InChIKey:ZICPIUMKKXKOCY-UHFFFAOYSA-N
ID: 29766
SMILES:C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC1C2O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.199
InChIKey:WQRZYYHVUYCXAI-UHFFFAOYSA-N
ID: 29767
SMILES:C1(C=O)Cc2c(cc(CCCCC)cc2O)OC1CC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.646
InChIKey:UDEMVNPFSATTME-UHFFFAOYSA-N
ID: 29768
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17
InChIKey:CGYHWLVCHKZQHO-UHFFFAOYSA-N
ID: 29769
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C(=O)O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 29770
SMILES:C(CCCC)c1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.844
InChIKey:KRXAOQXJDCENCL-UHFFFAOYSA-N
ID: 29771
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -18.036
InChIKey:BTTRWQMCLAXICU-UHFFFAOYSA-N
ID: 29772
SMILES:CC(=O)OCc1cc(OC)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.522
InChIKey:ZERYKTNQUMHSML-UHFFFAOYSA-N
ID: 29773
SMILES:c1(C)cc(=O)cc2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -15.15
InChIKey:OEZWHGYOJLLBKV-UHFFFAOYSA-N
ID: 29774
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.195
InChIKey:VPBHUGWJPCPNEC-UHFFFAOYSA-N
ID: 29775
SMILES:C1(Br)C(C)(C)Oc2c(cc(CCCCC)cc2O)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.288
CB1 binding score: -13.199
InChIKey:OVGWVDAJCRGEDZ-UHFFFAOYSA-N
ID: 29776
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 29777
SMILES:CCCCCc1cc(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 29778
SMILES:C(C=C(C)C=O)CC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.362
InChIKey:SCTYVZBLJHNBAI-UHFFFAOYSA-N