ID: 83896
SMILES:C1(C)CCC=C(C)C(C(=O)CCC)c2c(cc(CCC(OC)=O)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.478
InChIKey:ZASYDRFVBYFVOZ-UHFFFAOYSA-N
ID: 83897
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.157
InChIKey:AQTDTZMQZOPHMV-UHFFFAOYSA-N
ID: 83898
SMILES:C(C)c1cc(O)c2c(c1)OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 206.285
CB1 binding score: -16.827
InChIKey:QQLAQRCSGWPCHQ-UHFFFAOYSA-N
ID: 83899
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 83900
SMILES:Oc1cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 83901
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1(C)CC2C(O)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.901
InChIKey:ITOQGBOQMZLRDH-UHFFFAOYSA-N
ID: 83902
SMILES:c1(O)cc(O)c(CC=C(CCC=C(C)C)C)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 83903
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 83904
SMILES:C1=C(C)C(O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 83905
SMILES:CC1CC(CC(C)=C)=C(CCCC)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 220.356
CB1 binding score: -14.229
InChIKey:FMQAAQIOROWEER-UHFFFAOYSA-N
ID: 83906
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 83907
SMILES:C(C=C(C)CC)CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -15.813
InChIKey:XRRHJYCVLFXRCP-UHFFFAOYSA-N
ID: 83908
SMILES:C1CC2C(C)(C)Oc3cc(Oc4ccccc4C)cc(O)c3C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.458
CB1 binding score: -13.516
InChIKey:RKENWVOKPAQEOQ-UHFFFAOYSA-N
ID: 83909
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C)ccc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 83910
SMILES:c1(O)c2c(cc(O)c1)c1c(cc(CCCCC)cc1O)OC(C)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.369
InChIKey:XTYUOUMCUUHYCP-UHFFFAOYSA-N
ID: 83911
SMILES:C1C2(C)Oc3c(c(O)cc(C(C)C(CC)O)c3)C(C)CC1CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.334
InChIKey:QXQRSGWKAOCQCE-UHFFFAOYSA-N
ID: 83912
SMILES:OC(CO)c1cc2c(c(O)c1)C1C(CCC(C)=CC1)(O2)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.015
InChIKey:BLVRZFSLUHCJSU-UHFFFAOYSA-N
ID: 83913
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCC)cc2O)CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.669
InChIKey:YGZSJIYEFCIFBO-UHFFFAOYSA-N
ID: 83914
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3cc(CCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.144
InChIKey:QVOHZXGDRQEEJT-UHFFFAOYSA-N
ID: 83915
SMILES:c12cc(CCCCC)ccc1OC(C)(C)C1=C2CC(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -16.875
InChIKey:CWPDBKDVTAETDS-UHFFFAOYSA-N
ID: 83916
SMILES:c1(OCCCC)cc2c(c(C=O)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.142
InChIKey:MHXZDDLUAHUTTE-UHFFFAOYSA-N