ID: 33013
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.23
InChIKey:HMUKTCSXRGGZHP-UHFFFAOYSA-N
ID: 33014
SMILES:C12CC(O)C(=C)CCC1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.18
InChIKey:YZCGUHDHJJEMRW-UHFFFAOYSA-N
ID: 33015
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C(O)=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 33016
SMILES:C1CC2C3(CCC(O)(OC3)C2(C)C)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.025
InChIKey:PABQMZFRQVKXPO-UHFFFAOYSA-N
ID: 33017
SMILES:C(CCC)Cc1cc(O)c2c(c1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.622
InChIKey:VUACIIASMNRNBB-UHFFFAOYSA-N
ID: 33018
SMILES:C(C(C)C1CC2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2=O)C(O)C1)=C(C=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.32
InChIKey:WIXFWCLFEHVBCA-UHFFFAOYSA-N
ID: 33019
SMILES:O(c1cc(C2CC(=O)C(C)(CCC=C(C)CC(C=C(C)C)O)O2)cc(CCCCC)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -13.753
InChIKey:JDZHNKIAMIXMNO-UHFFFAOYSA-N
ID: 33020
SMILES:c12c(O)cc(CCCC)cc1C1C(C(C)(C)O2)CC(=O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.791
InChIKey:OWCDEYGEMUXKRW-UHFFFAOYSA-N
ID: 33021
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC1(C)CCC2C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.847
InChIKey:ZSSMVYYVRIZUPG-UHFFFAOYSA-N
ID: 33022
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 33023
SMILES:C12(C)C(COc3c(O)c(C(=O)OC)c(CCCCC)cc3O1)C(C(C)O)(O)CCC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.518
CB1 binding score: -11.717
InChIKey:LSXOKNIDDJSERU-UHFFFAOYSA-N
ID: 33024
SMILES:Cc1c(O)cc2c3c1OC(C)(C)C1C3C2C(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -14.391
InChIKey:MHJVKIKDNRHFSK-UHFFFAOYSA-N
ID: 33025
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2C(=O)C(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.879
InChIKey:ZBTJYLDHRSLXAE-UHFFFAOYSA-N
ID: 33026
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)C1CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.664
InChIKey:YYHPPOWPVCMNQZ-UHFFFAOYSA-N
ID: 33027
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -14.34
InChIKey:PSEKNVJEWMFHPY-UHFFFAOYSA-N
ID: 33028
SMILES:CC1=CC(c2c(O)cc(O)cc2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 33029
SMILES:c1(C)c(O)c(OC(NC)=O)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 327.38
CB1 binding score: -15.539
InChIKey:TYVKFQHRNRTQEM-UHFFFAOYSA-N
ID: 33030
SMILES:CSCC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.563
CB1 binding score: -18.371
InChIKey:ALBWXFZUWPVDFH-UHFFFAOYSA-N
ID: 33031
SMILES:C1(O)C2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C1CC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.481
InChIKey:LHRFFADPKFKZNT-UHFFFAOYSA-N
ID: 33032
SMILES:C1CC2C3C(Oc4c(O)c(C(OC)=O)c(CCCCC)cc4O2)C2OC(C)(C)C1C32
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -14.235
InChIKey:FDTHFQLJXKTGFI-UHFFFAOYSA-N
ID: 33033
SMILES:c1(CCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.334
InChIKey:MNUBYOPTBHHAIM-UHFFFAOYSA-N