ID: 121297
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 121298
SMILES:C1(O)C(O)C(c2c(O)cc(CCCCC)cc2OC)C(C(C)C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -14.927
InChIKey:KEJJIOOXDUGPEL-UHFFFAOYSA-N
ID: 121299
SMILES:C1(C(C)(O)C)C(c2cc(CCCCC)cc(O)c2C=O)C=C(CO)CCC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.226
InChIKey:YTBCTBPYWWCMJV-UHFFFAOYSA-N
ID: 121300
SMILES:C(C(C)=CCc1c(O)cc(CCCCC)cc1O)CCC(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -18.25
InChIKey:XORWRSXQGOTBKX-UHFFFAOYSA-N
ID: 121301
SMILES:C1=C(C)CCC(O)C(C)(C)Oc2c1c(O)cc(CCC(C(O)CC)=C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.471
InChIKey:SRNQBQHUXKZLMN-UHFFFAOYSA-N
ID: 121302
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 121303
SMILES:C(C)(=CC1C(CCCC)C(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.86
InChIKey:KFDFRYVHKPTKPY-UHFFFAOYSA-N
ID: 121304
SMILES:C1(COC(C)=O)=CC2C(C(C)(C)Oc3cc(C(CC(C)C)=O)c(O)c(CC=C(C)C)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -12.907
InChIKey:BRILNMWVTQQFSM-UHFFFAOYSA-N
ID: 121305
SMILES:c1(O)c(C2C=C(C)CC(c3c(O)c(CCC(CCC=C(C)C)C(O)(C)C)cc(CCCCC)c3)O2)cc(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.807
CB1 binding score: -15.519
InChIKey:AJENBHIKBMZLSS-UHFFFAOYSA-N
ID: 121306
SMILES:CC(O)(C)C1CCC(C)=CC1c1c(O)cc(CCC(O)=O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -16.53
InChIKey:MOCPRZYVCFFJNO-UHFFFAOYSA-N
ID: 121307
SMILES:Oc1c(CC2=CCCC3C2C(=O)OC(C)(C)C3=O)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.581
InChIKey:CNCMDXNHLJRACZ-UHFFFAOYSA-N
ID: 121308
SMILES:C1(C)C2CCC(C)=CC2c2c(cc(C)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.527
InChIKey:FMJNAKPTTHESLW-UHFFFAOYSA-N
ID: 121309
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 121310
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 121311
SMILES:C(CC(C(C)(C)Cl)Br)C(Br)(C)C1Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.738
CB1 binding score: -15.872
InChIKey:MEHRGRYJFMVXFQ-UHFFFAOYSA-N
ID: 121312
SMILES:CC(O)Cc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CC=C(CCC=C(C)CCC(OC)=O)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.563
CB1 binding score: -14.975
InChIKey:YEJSFDVNRNHGOV-UHFFFAOYSA-N
ID: 121313
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 121314
SMILES:O(C)C(=O)C1=CC2c3c(OC)cc(C)c(C)c3OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.348
InChIKey:XDWANHUNHSXDDC-UHFFFAOYSA-N
ID: 121315
SMILES:c1c(C)c2c(cc1)C(C)(C)Oc1c2c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -14.197
InChIKey:VOPYARQTVGFXOP-UHFFFAOYSA-N
ID: 121316
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 121317
SMILES:C1(COC(=O)CCCCCCCCCCCCC)=CCC2C(CC(=C)C)c3c(cc(CCCCC)cc3O)OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.84
CB1 binding score: -13.873
InChIKey:VFUHIDILDWTFQW-UHFFFAOYSA-N