ID: 25054
SMILES:O=C(c1c(O)cc(CCCCC)cc1)C1C(C=CC(=O)C)=C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.274
InChIKey:YWLPOWMOOQQITN-UHFFFAOYSA-N
ID: 25055
SMILES:COc1cc2c(cc1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.764
InChIKey:NRRZXOLZVDIGDT-UHFFFAOYSA-N
ID: 25056
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 25057
SMILES:O1C(C)(C)C2C(c3c(cc(CCCCC)cc3O)O1)C=C(C=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.116
InChIKey:GCPARFYKVQSKOE-UHFFFAOYSA-N
ID: 25058
SMILES:CC1C(=O)CC2C(C)(C)Oc3c(c(O)cc(CCCC)c3O2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -16.655
InChIKey:MGUIVDSZLAYTHL-UHFFFAOYSA-N
ID: 25059
SMILES:c12c(cc(CCCCC)c(C(=O)O)c1O)OC(C)(C)C(OC(=O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.411
CB1 binding score: -14.724
InChIKey:BBHWHVCUFGJLBO-UHFFFAOYSA-N
ID: 25060
SMILES:c1(OC)c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.277
InChIKey:WJABVLUXMBMMIO-UHFFFAOYSA-N
ID: 25061
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 25062
SMILES:c1(CC(CCC(=O)C(C)C)C)c2c(c(O)c(C)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.02
InChIKey:IZKHXOSNDHBEBR-UHFFFAOYSA-N
ID: 25063
SMILES:C12C(=C3c4c(C)c(CCCCC)ccc41)OC(C)(C)C3CCC(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.535
CB1 binding score: -13.123
InChIKey:TVQXSESTALJMCW-UHFFFAOYSA-N
ID: 25064
SMILES:C1CC23C(CCC2C)C(C)(C)Oc2cc(CCc4ccccc4)cc(c23)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.513
CB1 binding score: -13.346
InChIKey:XGBOALVEIUHYJM-UHFFFAOYSA-N
ID: 25065
SMILES:C1C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.796
InChIKey:BFFUWWHIAIGFJU-UHFFFAOYSA-N
ID: 25066
SMILES:C1CC(C(C)C)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -17.749
InChIKey:RYPNSSJHEQPCOF-UHFFFAOYSA-N
ID: 25067
SMILES:c1(C23OC45C(C=C(CO)CC4(O)C(O)C(C)(C)C5)C2c2c(O)cc(CCCCC)cc2O3)ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.639
CB1 binding score: -15.901
InChIKey:XRYDHFYCMFUNOY-UHFFFAOYSA-N
ID: 25068
SMILES:CC1(C)CCCC2(CO)c3c(OC(=O)CCCCCCC)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.737
CB1 binding score: -14.739
InChIKey:QESFUGCOSOLLBO-UHFFFAOYSA-N
ID: 25069
SMILES:C1(C)(C)CC2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.174
InChIKey:JWLDDCKIMMXROL-UHFFFAOYSA-N
ID: 25070
SMILES:C(OCCc1c2c(c(O)c(C)c1O)OC(C)(C)C1CCC(C)=CC21)(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.176
InChIKey:CNNQVYBSXHHXJZ-UHFFFAOYSA-N
ID: 25071
SMILES:c1(C)c(-c2c(C)cccc2C)c2c(cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 346.514
CB1 binding score: -13.806
InChIKey:MGJJXFSXNFMJLJ-UHFFFAOYSA-N
ID: 25072
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 25073
SMILES:Cc1cc(OC(=O)CCCCCCCCCCC)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.044
InChIKey:GWHPVCLELGESFX-UHFFFAOYSA-N
ID: 25074
SMILES:O=C1C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N