ID: 91645
SMILES:C1C(C)C2C3C(CC2=O)(c2c(cc(CCCCC)cc2O)O3)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.457
InChIKey:ZFDOUULMQXEQQA-UHFFFAOYSA-N
ID: 91646
SMILES:c1(CCCCC)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 91647
SMILES:C(c1cc2c(cc1C)OC(C)(CCC=C(C)C)C=C2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.642
InChIKey:RWRUWLYAAAHGGL-UHFFFAOYSA-N
ID: 91648
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 91649
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 91650
SMILES:C1CC2(C)C(c3c(O)cc(CCCCC)cc3O)OC3(C(C)=C1O)CCC(C(C)C)=C3C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -13.362
InChIKey:JXOHDZUREQNFNH-UHFFFAOYSA-N
ID: 91651
SMILES:C(C1(c2c(OC)cc(CCCCC)cc2O)C=C(C)CCC1)OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.871
InChIKey:FSBQBONLUFTBHP-UHFFFAOYSA-N
ID: 91652
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 91653
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
ID: 91654
SMILES:C1(CC=C(C)CCC=C(C)C)Oc2cc(CCCCC)cc(O)c2C(=O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.589
InChIKey:BEJGJACXKFHJMR-UHFFFAOYSA-N
ID: 91655
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(C)c3)C(O)C2C(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.227
InChIKey:GOUWEMPCQYCBEQ-UHFFFAOYSA-N
ID: 91656
SMILES:C1CC(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.844
InChIKey:PWPQLXXOFXROSJ-UHFFFAOYSA-N
ID: 91657
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c4c(c(O)c(C)c32)c(O)cc(C)c4)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -14.748
InChIKey:VRIXBMNQHUUECN-UHFFFAOYSA-N
ID: 91658
SMILES:c1(CCCCC)cc2c(c(OC(=O)CC)c1)C3(C)C2CCC1C(C)(C)OC3CC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -14.614
InChIKey:DUZXMGADAKKFRJ-UHFFFAOYSA-N
ID: 91659
SMILES:C(c1cc(C(=O)CC2(O)C=C(C)C(=O)C(C)(C)O2)c(CCCCC)cc1O)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.688
CB1 binding score: -17.025
InChIKey:HXGPOSXMIBRMCB-UHFFFAOYSA-N
ID: 91660
SMILES:C1(c2c(O)cc(CCCCC)c(C=O)c2O)C2(O)COC(=O)C23C=CCC(C)(C)C3=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.509
CB1 binding score: -15.267
InChIKey:PEKCHOBUMPUPBU-UHFFFAOYSA-N
ID: 91661
SMILES:CCC(c1c(O)c2c(c(C(=O)CCCCC)c1)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -11.278
InChIKey:CURWWQXMTXPXOL-UHFFFAOYSA-N
ID: 91662
SMILES:C(CCCCCO)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.641
InChIKey:WVWANISXDKMKTE-UHFFFAOYSA-N
ID: 91663
SMILES:C1=C(C)CCC(C(C)=CC(C=C(C)C)=O)C1c1c(O)cc(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.037
InChIKey:JCUDPNKVDWFDFI-UHFFFAOYSA-N
ID: 91664
SMILES:C1=C(C)C(Cc2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.65
InChIKey:LDTXEPMFZIMKKD-UHFFFAOYSA-N
ID: 91665
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1=C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -17.97
InChIKey:LCKQBFMKWBZWKP-UHFFFAOYSA-N