ID: 88747
SMILES:c1(C=CC)c2c(cc(O)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -17.568
InChIKey:CRHUHULZMCDJAD-UHFFFAOYSA-N
ID: 88748
SMILES:CC1=C2Cc3c(CCCCC)cccc3OC2(C(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.713
InChIKey:ADXPQTQXGNVSLC-UHFFFAOYSA-N
ID: 88749
SMILES:C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.929
InChIKey:HODHSCXHGRXRRQ-UHFFFAOYSA-N
ID: 88750
SMILES:C1(C)(C)Oc2c(c(OC)cc(CCCCC)c2)C2C=C(C(=O)O2)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.631
InChIKey:XVVIWMUBFPQYLB-UHFFFAOYSA-N
ID: 88751
SMILES:Cc1c(O)cc2c(c1CC(O)C(=C)C)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.157
InChIKey:ILJUHIHAKZEQDP-UHFFFAOYSA-N
ID: 88752
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 88753
SMILES:CC(=C)C(OC)c1c(O)ccc(O)c1C1C(C(=C)C)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.039
InChIKey:AEPDTFUTKKTAKA-UHFFFAOYSA-N
ID: 88754
SMILES:C1C(C(=C)C)C(c2c(O)c(C(O)=O)c(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.365
InChIKey:WVOLTBSCXRRQFR-UHFFFAOYSA-N
ID: 88755
SMILES:C1(Br)C(C)(C)C2C(C)(CC1Br)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.277
CB1 binding score: -16.069
InChIKey:XVYFFYRHDGDOIY-UHFFFAOYSA-N
ID: 88756
SMILES:c12c(c(CCCCC)ccc1)OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.367
CB1 binding score: -17.978
InChIKey:XPZBKSGODZVBTO-UHFFFAOYSA-N
ID: 88757
SMILES:C1(C(=O)C)=CC2(Oc3c2c(O)cc(CCCCC)c3)CC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -11.821
InChIKey:QVHWXAFIAQUVFN-UHFFFAOYSA-N
ID: 88758
SMILES:CC1(C)OC1C(O)CC1(C)C2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.797
InChIKey:HCDHGQJPNQLUDV-UHFFFAOYSA-N
ID: 88759
SMILES:C(CC=C(C)C)C1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 88760
SMILES:C(=C(C)CC=CC(OC(C)=O)(C)C)Cc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.552
InChIKey:SVLPJTMRYVEODV-UHFFFAOYSA-N
ID: 88761
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)C1CC1C(=C)C(=O)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -17.334
InChIKey:GQEDFXZPXWQMJU-UHFFFAOYSA-N
ID: 88762
SMILES:C1(C)(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: 88763
SMILES:C1CC2(C(C)C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.55
InChIKey:HQSVTWSYVZRBHB-UHFFFAOYSA-N
ID: 88764
SMILES:c1(CCN)cc(O)c(C2C(C(=C)C)CCC(C)=C2)cc1OS(=O)(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 367.467
CB1 binding score: -16.822
InChIKey:OKZBGONMAAKUME-UHFFFAOYSA-N
ID: 88765
SMILES:C1(=O)C(C)(C)C2c3c(cc(CCCCC)cc3OC3(C)C(CCC(C=O)=CC3)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -15.519
InChIKey:ZJDRGFOQUGATNM-UHFFFAOYSA-N
ID: 88766
SMILES:CC12CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.943
InChIKey:TUXYVWWGZQJUFK-UHFFFAOYSA-N
ID: 88767
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N