ID: 105400
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.8
InChIKey:RAYRUJHFLUVASM-UHFFFAOYSA-N
ID: 105401
SMILES:C1(C)=CC(c2c(OC)cc(OC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.651
InChIKey:RBOIQFDUPWFAHT-UHFFFAOYSA-N
ID: 105402
SMILES:C1CCC(C)C(c2c(O)cc(CCCCC)cc2O)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.36
InChIKey:BAKNHRVZSBWBBW-UHFFFAOYSA-N
ID: 105403
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C(C)(O)CC1)C(CC(O)CCC)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -15.367
InChIKey:UWZOBXYQLPTWLD-UHFFFAOYSA-N
ID: 105404
SMILES:C1CC(C(=O)O)=CC2C1C(C)(C)Oc1c2cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 288.343
CB1 binding score: -17.196
InChIKey:JQKMXCOKTFPPAA-UHFFFAOYSA-N
ID: 105405
SMILES:C(=O)(c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1C)CC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.227
InChIKey:OHSXLOCJYRNDJC-UHFFFAOYSA-N
ID: 105406
SMILES:CC(C)=CCc1c(O)c(CC=C(C)CCC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 105407
SMILES:C1C=C2C3(C(C(=O)c4cc(O)ccc4O)OC3(C)C)C(C)CCC2C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -13.749
InChIKey:YYBNMDYWIYYSGY-UHFFFAOYSA-N
ID: 105408
SMILES:c1c(O)cc(C(CC)(C=C)CC(CC(C)C)O)cc1Oc1cc(CCCCC)cc2c1CC(C(C)=C)C1=C(C(=O)c3cc(cc(O)c3)OC1(C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 720.947
CB1 binding score: -12.052
InChIKey:BKLLBBYQXJRZKB-UHFFFAOYSA-N
ID: 105409
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 105410
SMILES:Oc1c(CCCCC)cc2c(c1O)C1C=C(CCC=C(C)CC1)CO2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.565
InChIKey:LOFHSJCCQLNPHN-UHFFFAOYSA-N
ID: 105411
SMILES:Oc1c(CC=C(C)CCC=C(CCC=C(COC(=O)C(CC)C)C)C)c(O)cc(CCc2cc(OC)c(O)cc2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.763
CB1 binding score: -14.926
InChIKey:SVJUCKWDHTVIAH-UHFFFAOYSA-N
ID: 105412
SMILES:Oc1c(CC=C(CCC(=O)C(C)=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.095
InChIKey:QHVZLGLIPCDSKP-UHFFFAOYSA-N
ID: 105413
SMILES:O(Cc1cc(OC)c(CC=C(CCC=C(C)C)C)c(O)c1)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.522
InChIKey:ZERYKTNQUMHSML-UHFFFAOYSA-N
ID: 105414
SMILES:C1OC2(C)C3C(C)(CCC3C(C)CCCC(C)COC(C)=O)Oc3c(c(O)cc(C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -15.178
InChIKey:WZICBVXCSDCRFJ-UHFFFAOYSA-N
ID: 105415
SMILES:C1(CCC(O)=O)(C)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.696
InChIKey:YZWFCZSGMRLLOL-UHFFFAOYSA-N
ID: 105416
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCC)cc1O)(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 105417
SMILES:Oc1cc(CCCCC)cc2c1C1C3C(O)(CCC1(C)O3)C(C)(C)C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.03
InChIKey:VIUCKEKOVWZXAL-UHFFFAOYSA-N
ID: 105418
SMILES:C(Cc1cc(O)c2c(c1)OC(C(C)(C)O)CC2)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -18.012
InChIKey:BWTXRXWJBUBROE-UHFFFAOYSA-N
ID: 105419
SMILES:c1(O)cc(CCC)c(O)cc1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.95
InChIKey:YCGKZROQHXAHBE-UHFFFAOYSA-N
ID: 105420
SMILES:c1(O)cc(C)c(C2C(C(=C)CO)CCC(C)=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.288
InChIKey:MNBXXWKCWPXLJT-UHFFFAOYSA-N