ID: 110545
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C2C1(O)CC(OC)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.491
CB1 binding score: -13.237
InChIKey:KJJKDRRGZAOAKL-UHFFFAOYSA-N
ID: 110546
SMILES:C1=C(C)CC(c2c(O)cc(OC)cc2O)C(C(C)=C)C1CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.556
InChIKey:JEEYGBPBOWIMDK-UHFFFAOYSA-N
ID: 110547
SMILES:C(CCc1cc(O)c2c(c1)OC1(C)CCC(C(C)(C)O)OC1C2)(C)(C)C(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -15.929
InChIKey:JCPTWUZJYAACHM-UHFFFAOYSA-N
ID: 110548
SMILES:Oc1cc(C)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 110549
SMILES:CC1=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: 110550
SMILES:C=CCc1cc(O)c2c(c1)OC1(C)C(C2)C(C(CCC=C(C)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -9.086
InChIKey:XAAYVFDEQPPGLA-UHFFFAOYSA-N
ID: 110551
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)CC1(C=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.783
InChIKey:IXQHAKFRMXIBCD-UHFFFAOYSA-N
ID: 110552
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1c2c(O)c(OC)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.748
InChIKey:PKNNAKAYCYJMLR-UHFFFAOYSA-N
ID: 110553
SMILES:c1c2c(cc(C)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.878
InChIKey:GUXGXKFPIHIMLU-UHFFFAOYSA-N
ID: 110554
SMILES:Oc1cc(CC=C(CCC=C(C)C)C)c(O)cc1CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.331
InChIKey:LILBTFSPJICHKR-UHFFFAOYSA-N
ID: 110555
SMILES:C1(C(C)(C)OC)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.364
InChIKey:WMVGNJCRBSITQR-UHFFFAOYSA-N
ID: 110556
SMILES:C1(=O)c2ccc(CCCC)cc2OC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.586
InChIKey:RNVSLYOQCUAYNK-UHFFFAOYSA-N
ID: 110557
SMILES:C=C1C(=O)CC2C(C1)c1c(cc(CCCCC)cc1OC)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.693
InChIKey:SELGFVXOBYLNJX-UHFFFAOYSA-N
ID: 110558
SMILES:C1(C)=CC2C(CC1O)C(C)(C)Oc1c2ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.229
InChIKey:WPXCENVWOMHAGF-UHFFFAOYSA-N
ID: 110559
SMILES:C1(C)(N)C(c2c(O)cc(CCC)cc2O)C=C(C)CCC=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.511
CB1 binding score: -14.416
InChIKey:ADIDBAANVBTLPF-UHFFFAOYSA-N
ID: 110560
SMILES:c1(CC=C(C)C)c(Oc2cc(CCCCC)cc(OC)c2CC=C(C)C)cc(O)c2c1OC(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -15.533
InChIKey:OECKSKHXSXUMNM-UHFFFAOYSA-N
ID: 110561
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.133
InChIKey:OSYWSWBYPAAZHP-UHFFFAOYSA-N
ID: 110562
SMILES:C(CC(O)C(=C)C)C1(C)C(O)Cc2c3c(cc(C(=O)O)c2)OC(C)(C)C1C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.767
InChIKey:HBKDSPCLMBNPFM-UHFFFAOYSA-N
ID: 110563
SMILES:c1c(O)c(O)c(C)c2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.692
InChIKey:GBBZTPLMFCJYQR-UHFFFAOYSA-N
ID: 110564
SMILES:C12(C)C(O)CC(C(O)=O)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.437
InChIKey:BEDMBNBYUSKEEH-UHFFFAOYSA-N
ID: 110565
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.066
InChIKey:LKJJKCPYQMCAPR-UHFFFAOYSA-N