ID: 101599
SMILES:c1(CCCCC)c(C(O)=O)c(O)c(C2C=C(C)CCC2C(C)=C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.202
InChIKey:FTLGHBIPNFSIER-UHFFFAOYSA-N
ID: 101600
SMILES:c1(CC=C(CCC=C(C)C=O)C)c(O)cc(CCCCC)cc1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.982
InChIKey:WPMJSLHOUABYAU-UHFFFAOYSA-N
ID: 101601
SMILES:C(Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.752
InChIKey:XOAHTHGPQALFJE-UHFFFAOYSA-N
ID: 101602
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.945
InChIKey:BMHWBDFIQAZUEO-UHFFFAOYSA-N
ID: 101603
SMILES:CC1CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.563
InChIKey:CODIXLGYYWMJFS-UHFFFAOYSA-N
ID: 101604
SMILES:C(=O)(OC1CC(C)=CC2c3c(cc(CCC)cc3OC)OC(C)(C1)C2C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.434
InChIKey:NFPYSWSVJPCUCD-UHFFFAOYSA-N
ID: 101605
SMILES:c12c(cc(CCCCC)cc1OC)OC1C(=O)OC(C2C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.408
InChIKey:OMZDSXYOBNKUIC-UHFFFAOYSA-N
ID: 101606
SMILES:Nc1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 259.349
CB1 binding score: -15.929
InChIKey:KFOPTTZSUWCOIL-UHFFFAOYSA-N
ID: 101607
SMILES:Oc1cc(O)c(C(=O)C(C)C)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 101608
SMILES:C(c1cc(CCC2(C)C(C)C(C)=CCC2)cc(O)c1)(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.569
InChIKey:BVZSYYQVHXZYHK-UHFFFAOYSA-N
ID: 101609
SMILES:C1C(C)(C)OC(=O)C=C(C)C2Oc3c(c(O)cc(CCCCC)c3)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.356
InChIKey:RTLZJKMIYICLDY-UHFFFAOYSA-N
ID: 101610
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)c1ccc(O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: Not available
InChIKey:GSHVJFMOVBKXGW-UHFFFAOYSA-N
ID: 101611
SMILES:C(=C)(C)C1C2c3c(cc(CCCCC)cc3O)OC(C)(C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.742
InChIKey:FQXHQOYLNLLFEC-UHFFFAOYSA-N
ID: 101612
SMILES:CC(=CC1c2c(O)cc(CCC(=O)O)cc2OC1(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -13.374
InChIKey:JOVCYDIOZQKAOY-UHFFFAOYSA-N
ID: 101613
SMILES:c1c(OC)ccc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -20.527
InChIKey:OMIDBQNIZTZCJZ-UHFFFAOYSA-N
ID: 101614
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)cc(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.051
InChIKey:TXLIVWXFPYVBTA-UHFFFAOYSA-N
ID: 101615
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.84
InChIKey:CIDSACROHFISMP-UHFFFAOYSA-N
ID: 101616
SMILES:c1(C)c(Br)c(-c2cc3c(c(=O)o2)CC2(O)C(C)(C)CCCC2(C)C3)c(Oc2cc(CCCCC)ccc2C(CCCCC)=C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 689.775
CB1 binding score: -14.818
InChIKey:XWFDTKLTFZFXNB-UHFFFAOYSA-N
ID: 101617
SMILES:C(C1(C)CC(=O)CC(C)(C)O1)CCC(C)=CCc1cc(O)c(C)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -11.822
InChIKey:IOOZQVUKLSDRTE-UHFFFAOYSA-N
ID: 101618
SMILES:C12(C)C3C(C)(C)C1CCC2(C)Oc1c(c(O)cc(CCCCC)c1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 342.523
CB1 binding score: -13.383
InChIKey:WDABFNLWXHQAFS-UHFFFAOYSA-N
ID: 101619
SMILES:C12(c3c(O)cc(CCCCC)cc3OC1(C)C)CC(C(C)=C)C(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.91
InChIKey:WTHHVZOLQACPID-UHFFFAOYSA-N