ID: 34714
SMILES:C1C2C(C)CCC2C(C)(C)Oc2c(c(O)cc(CCCCCC)c2)C2C(C)CC(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -15.648
InChIKey:ADWGRMPOHRBHBD-UHFFFAOYSA-N
ID: 34715
SMILES:CC(=CCCC(=CCc1c(O)c(O)cc(CCCCC)c1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.682
InChIKey:LDSLGHZIOIUHGN-UHFFFAOYSA-N
ID: 34716
SMILES:C1(C(=C)C)C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 34717
SMILES:C(C(C=C1C(=O)c2c(cc(CCCCC)cc2O)OC1C)CC=C(C)C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.925
InChIKey:OLMTTYPBGWWCCP-UHFFFAOYSA-N
ID: 34718
SMILES:c1cc(I)c(CCCCCC)c2c1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.393
CB1 binding score: -13.511
InChIKey:XSBUGWURYCQEEC-UHFFFAOYSA-N
ID: 34719
SMILES:CC1=CCC(=C(C)C)C(c2c(O)cc(CCCCC)c(OC)c2O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.028
InChIKey:DHGNBKHLWMOMKB-UHFFFAOYSA-N
ID: 34720
SMILES:C12c3c(O)c(C)c(OC(CCCCC)=O)cc3OC(C)(C)C1CCC1(C)C2CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -17.458
InChIKey:JKSAFBAXJVQYKG-UHFFFAOYSA-N
ID: 34721
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 34722
SMILES:C1(=O)C(C)Oc2cc(C)c(O)cc2C1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.507
InChIKey:SOEWRNVGCRPORB-UHFFFAOYSA-N
ID: 34723
SMILES:C(CCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1)CCc1c(C)c(CCC(CO)=CCO)oc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.715
CB1 binding score: -14.928
InChIKey:JYTPVPMDXZFPQO-UHFFFAOYSA-N
ID: 34724
SMILES:c1(CC(C(OC)OC)C=O)cc(CCCCC)cc2c1OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -15.047
InChIKey:JDVNOFVSWNAWNX-UHFFFAOYSA-N
ID: 34725
SMILES:c1(CC23OC4(C(=CC2=O)C3)c2c(cc(CCCCC)cc2O)OC4(C)C)ccc(O)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.532
CB1 binding score: -13.258
InChIKey:ZAYSLUXEMXIUQF-UHFFFAOYSA-N
ID: 34726
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C=C(C(O)=O)C(O)CCC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -12.152
InChIKey:PLBOAKYDXUDSLT-UHFFFAOYSA-N
ID: 34727
SMILES:C(=O)(O)c1c(CCCCC)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.494
InChIKey:VITZNDKHSIWPSR-UHFFFAOYSA-N
ID: 34728
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 34729
SMILES:C(O)(=O)c1c(CCCCC)cc2c(c1O)CC1CC(C(C)(C)O1)CCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.312
InChIKey:ZMWPNPJYPXOSAM-UHFFFAOYSA-N
ID: 34730
SMILES:c1(O)cc(COC(C(C)=C)=O)c(O)c2c1C(CC(C)C)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.479
InChIKey:FRUWKVAJGPQHMR-UHFFFAOYSA-N
ID: 34731
SMILES:c1(CCCC)cc2c(c(O)c1)C1C=C(COC(CCC)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.605
InChIKey:UTNMMXIQPPPYCZ-UHFFFAOYSA-N
ID: 34732
SMILES:O(C(C)=O)C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(C(C)C)CCC31C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.411
InChIKey:JPRZQFHCVSLPTR-UHFFFAOYSA-N
ID: 34733
SMILES:c1c(CCCCC)cc2c(c1O)C1=C(C(C)CC2)C(C=C(C)C)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.005
InChIKey:YRLZBXOGXORHMC-UHFFFAOYSA-N
ID: 34734
SMILES:C1(C(C)C)Oc2cc(CCCCC)cc(O)c2C1C=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.75
InChIKey:JJRWSCJVSQWXFF-UHFFFAOYSA-N