ID: 90427
SMILES:C(c1cc(CCC2C3C(C(CCC(=O)O)(C)O2)C(C)(C)OC3(C)C)cc(O)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -14.204
InChIKey:WIMHKXFHGIRTTA-UHFFFAOYSA-N
ID: 90428
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 90429
SMILES:O=Cc1c(CCCCC)cc2c(c1O)C1(C=O)C(CC(C)(C)O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -14.038
InChIKey:NHEZDPJXUKGYTD-UHFFFAOYSA-N
ID: 90430
SMILES:O(c1c2c(OC)c(CCCCC)cc1OC(C)(C)c1c-2cc(C)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -10.197
InChIKey:SMQKATURGHRIOI-UHFFFAOYSA-N
ID: 90431
SMILES:c1(C)cc(O)c2c(c1)OC(C)(CCC1=C(C)CCC(C(O)(C)C)O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.506
InChIKey:PDFHJUXASSYLLR-UHFFFAOYSA-N
ID: 90432
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccc(O)cc3C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.01
InChIKey:MMHWWLXBHPPCDZ-UHFFFAOYSA-N
ID: 90433
SMILES:C12C(CC(=O)C1CC=C)C(C)(C)Oc1c2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.829
InChIKey:XGNAQLOFMSDQEO-UHFFFAOYSA-N
ID: 90434
SMILES:C(CCCCC)Cc1cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -16.036
InChIKey:YPAUMXQFHYZVDJ-UHFFFAOYSA-N
ID: 90435
SMILES:c1(OC2C(O)C(O)C(O)C(CO)O2)c(CC=C)cc(O)c2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.539
CB1 binding score: -16.542
InChIKey:KZLINSVIXOUQAT-UHFFFAOYSA-N
ID: 90436
SMILES:C=C1C(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.97
InChIKey:AIHNGABCBKGSCG-UHFFFAOYSA-N
ID: 90437
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 90438
SMILES:O=C(OC)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.122
InChIKey:GHQWHEOOZNZPEX-UHFFFAOYSA-N
ID: 90439
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.968
InChIKey:YUMMIAMBVUHOHK-UHFFFAOYSA-N
ID: 90440
SMILES:CC(C=O)C1CC(C(=C)C)C(c2c(O)cc(CCC)cc2OCC=C(C)C=CC2OC2(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -12.523
InChIKey:FSCTVRNARHXVLH-UHFFFAOYSA-N
ID: 90441
SMILES:O=C(OC)c1c(CCCCC)cc2c(c1O)C1=C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.956
InChIKey:LXKUXQAWGSDEEA-UHFFFAOYSA-N
ID: 90442
SMILES:CC1=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC#CCCC(O)CCOc4c(C=O)c(O)c(C=O)c(O)c4C=C(C)CCC=C(C)C)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 712.924
CB1 binding score: -13.342
InChIKey:KMEWGNZOLWQMCQ-UHFFFAOYSA-N
ID: 90443
SMILES:C12C(C)CC=C3C(C)(C)Oc4cc5c(c(O)c4C3C1(C)CCC1=C2COC1=O)OC(C)C(C)(CC)O5
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -16.256
InChIKey:DLXALZUIDLUWOH-UHFFFAOYSA-N
ID: 90444
SMILES:c1(CCCCC)cc(O)c2c3c1C1C(C(C)(C)C2C(=O)C3O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.068
InChIKey:KVNJVYKGNUAMBG-UHFFFAOYSA-N
ID: 90445
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 90446
SMILES:CC(C1=CC2C(C)(Oc3cc(CCCC)cc4c3C1(OO)CC1C(C)(O)CCC1C(C)(C)O4)CC2)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.823
CB1 binding score: -16.066
InChIKey:YWQQJFWKDOIHIM-UHFFFAOYSA-N
ID: 90447
SMILES:C1C(C)(C)C2(C(C)=CC1)Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.263
InChIKey:SOFVNKJRFHIBDF-UHFFFAOYSA-N