ID: 132595
SMILES:c1(C2C(C(C)C)CCC(CO)=C2)cc(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 316.485
CB1 binding score: -16.502
InChIKey:FLXYTXSMQDLQOS-UHFFFAOYSA-N
ID: 132596
SMILES:C(OC)(=O)CC1CC(C(CC)C)=CC2c3c(cc(CCCCC)cc3O)OC(=O)C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.869
InChIKey:OPWOWKZVLSWQEB-UHFFFAOYSA-N
ID: 132597
SMILES:O1c2cc(CCCCC)cc(OC)c2C2C1(C(C)C)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.827
InChIKey:LXTRYPPJUMPLMC-UHFFFAOYSA-N
ID: 132598
SMILES:C(=C(C)C)C(O)CC1(C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.956
InChIKey:JEKXHWPGFNFNEO-UHFFFAOYSA-N
ID: 132599
SMILES:C12(O)c3c(cc(C)c(Br)c3O)OC1(CC(O)C(C)(C)OC2CCCC)C1OC2(C)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 553.534
CB1 binding score: -13.763
InChIKey:QAKTUAVVBCYUND-UHFFFAOYSA-N
ID: 132600
SMILES:Oc1cc2c(cc1CCCCC)OC(C)(C)C1C(O)CC(=C)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.998
InChIKey:WSNVBLBWJZVPMC-UHFFFAOYSA-N
ID: 132601
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 132602
SMILES:C1=C(C)C2CC(O)C(C)(C)C2Cc2c1cc(CCCCC)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.688
InChIKey:WYXIBGDMJXTJGV-UHFFFAOYSA-N
ID: 132603
SMILES:c12c(cc(CCCCC)cc1OC)OC(CCC(C(O)(C)C)O)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.339
InChIKey:TZIKJIZHBHLNSA-UHFFFAOYSA-N
ID: 132604
SMILES:C(CCCCCCCCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -18.334
InChIKey:BKUUXHSLBMOYBZ-UHFFFAOYSA-N
ID: 132605
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 132606
SMILES:C1(C(C)(OC(=O)CC(O)(C)C)C)CCC(C)=CC1c1c(CCCCC)cc(Oc2c(O)cc(CCCCC)cc2)cc1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.844
CB1 binding score: -15.803
InChIKey:WRWLHEYHDGAQOC-UHFFFAOYSA-N
ID: 132607
SMILES:c1(O)c(O)cc(C)c(C2C(C(C)=C)CCC(C)=C2)c1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.682
InChIKey:QAILMHUWHCLUAB-UHFFFAOYSA-N
ID: 132608
SMILES:CC(=O)OC1C(C(C)=C)C(c2cc(CCCC(O)CCc3ccccc3)cc(CC=C(C)C)c2)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.75
CB1 binding score: -14.239
InChIKey:AUKWFZCXXZRSPT-UHFFFAOYSA-N
ID: 132609
SMILES:C1(O)C(C=CC=C(CCC=C(C)C)C)(C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.803
InChIKey:FGQYJALPYGQQHL-UHFFFAOYSA-N
ID: 132610
SMILES:C12c3c(O)cc(CCCCC)cc3OC(c3c(O)cc(OC)c(Cl)c3CC=C(C)C)(C1)C2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 485.064
CB1 binding score: -13.529
InChIKey:QYJZQFKQRYYYPG-UHFFFAOYSA-N
ID: 132611
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.407
InChIKey:VGRSCQCCQRLAHM-UHFFFAOYSA-N
ID: 132612
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(CCC(C(=C)C)C2(CCC(=O)O)C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.762
InChIKey:ZCAXUWUMJCIQII-UHFFFAOYSA-N
ID: 132613
SMILES:C1(C(C)C)C(c2c(O)cc(CCC)cc2O)CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -19.319
InChIKey:VNFNICPIQJPBJY-UHFFFAOYSA-N
ID: 132614
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 132615
SMILES:CC1(C)Oc2c(c(OC(=O)C)c(OC(C)=O)c(CCCCC)c2)C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.057
InChIKey:QNUGKZCQRRJYOK-UHFFFAOYSA-N