ID: 70225
SMILES:Oc1c(CC=C(C)CC2(C)CCC(=O)C(C)(C)O2)cc(O)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.537
InChIKey:CVDPZQVKUVTYCO-UHFFFAOYSA-N
ID: 70226
SMILES:C1(C)(CCC(O)C(=C)C)Oc2cc(CCCCC)c(C(OC)=O)c(O)c2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -15.338
InChIKey:LYPOFRHHRUXKJQ-UHFFFAOYSA-N
ID: 70227
SMILES:C12=C(C=C(C(C)C)CCC1C)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.609
InChIKey:OPBCPCHJKIGSEU-UHFFFAOYSA-N
ID: 70228
SMILES:c12cc(CCCCC)cc(O)c1OC1(C)CCCC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.298
InChIKey:BXDONIIVZXTLCN-UHFFFAOYSA-N
ID: 70229
SMILES:COc1c(C(O)=O)c(CCCCC)cc2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.636
InChIKey:QPWYVSJCJBRWRB-UHFFFAOYSA-N
ID: 70230
SMILES:C12(Oc3c(c(O)cc(CCCCCC)c3)C1O)Oc1cc(ccc1O)C1=C(C(C)(C)CCC1)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -17.057
InChIKey:FEESWUIUYFYCFU-UHFFFAOYSA-N
ID: 70231
SMILES:c1(O)cc(CCCCC)c2c(c1)C1C(C(O)(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.561
InChIKey:VTOFRXDIPRGEPI-UHFFFAOYSA-N
ID: 70232
SMILES:c12c(c(O)cc(CCCCC)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
ID: 70233
SMILES:Oc1c(C(C(C)C)CCC(C)=C)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -12.026
InChIKey:MLMALJCOFBSJHG-UHFFFAOYSA-N
ID: 70234
SMILES:C(CCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)(O)C1CC(C(C)=C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.482
InChIKey:OFDRXAAJZFHOEU-UHFFFAOYSA-N
ID: 70235
SMILES:CC(=C)C1CCC2(C(=O)O)C1C1c3c(ccc(O)c3)OC(C)(CCCc3ccccc3)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.587
CB1 binding score: -16.24
InChIKey:VWXWJBUUZUCBSA-UHFFFAOYSA-N
ID: 70236
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 70237
SMILES:C12C(C)(C)CCCC1(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 70238
SMILES:C(CCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(=O)O2)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.514
InChIKey:UMTJPJDSQCDXBS-UHFFFAOYSA-N
ID: 70239
SMILES:C(CCCc1cc2c(c(O)c1)C1(C)CC(O)CC(C)(C)C1CC2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -17.086
InChIKey:DYMNYRCGDOTALQ-UHFFFAOYSA-N
ID: 70240
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 70241
SMILES:O=Cc1c(O)c(C(=O)CCC(C)C)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -13.736
InChIKey:OYBUHJJAIKZEHY-UHFFFAOYSA-N
ID: 70242
SMILES:C(CCC)CCc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(C2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -17.465
InChIKey:LSLUXHRPXNKYBR-UHFFFAOYSA-N
ID: 70243
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(CCC=C(C(=O)OC)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -11.405
InChIKey:RIMCTTAXKRRFGB-UHFFFAOYSA-N
ID: 70244
SMILES:C(C1CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)O1)(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.82
InChIKey:ITACKOGDYFONBT-UHFFFAOYSA-N
ID: 70245
SMILES:c1c(CCCCC)c(O)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 316.485
CB1 binding score: -17.394
InChIKey:MYUUBTAELPINEG-UHFFFAOYSA-N