ID: 54706
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54707
SMILES:c1(CC(O)=O)cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.352
CB1 binding score: -16.689
InChIKey:NDXJBXODWDGZJD-UHFFFAOYSA-N
ID: 54708
SMILES:CC(C)=CC1CC(C)C2c3c(c(C(C(CC)C)=O)c(O)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.686
InChIKey:YYIIQRIVWGKAIG-UHFFFAOYSA-N
ID: 54709
SMILES:C(c1ccc(O)cc1)c1cc(OC)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -15.404
InChIKey:CIMQAFDYVHZYNR-UHFFFAOYSA-N
ID: 54710
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54711
SMILES:C(=O)(OC)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 54712
SMILES:C1(C)=CC23C=CC(C)=CC2c2c(O)cc(C)cc2OC(C)(C)C(C3O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -15.955
InChIKey:AKFVXJLGIBUYSS-UHFFFAOYSA-N
ID: 54713
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: 54714
SMILES:CC1CC2C(C(C)(C)Oc3c(c(OC)cc(CCC)c3OC)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.434
InChIKey:ZDLPIKRKLXJILL-UHFFFAOYSA-N
ID: 54715
SMILES:C(C)CCCc1c(C(O)=O)cc(C2C=CC(CCC=C(C)CO)(C)O2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.394
InChIKey:UYAKTPDCNPMZNQ-UHFFFAOYSA-N
ID: 54716
SMILES:CC(=CCCC(CC)=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 370.577
CB1 binding score: -16.015
InChIKey:PWMSEKKCDIZMLN-UHFFFAOYSA-N
ID: 54717
SMILES:c1(CC=Cc2occ(C(=O)O)c2CC=C(C)CCC=C(C)C)cc(O)c(C2c3c(cc(CCCCC)cc3O)OC2(C)C)c(O)c1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 642.833
CB1 binding score: -13.842
InChIKey:JVBBRXXZTNNCIZ-UHFFFAOYSA-N
ID: 54718
SMILES:C1(C)=CCCC2(C)Oc3c(c(O)cc(C(C)O)c3)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.943
InChIKey:XLFHWGAGBLNUGB-UHFFFAOYSA-N
ID: 54719
SMILES:C1CC2C(C)(C)Oc3c(c(OC)cc(CCCCC=CCC)c31)C1C2(C)CCC(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -16.339
InChIKey:AHCIJPIGYLDYBD-UHFFFAOYSA-N
ID: 54720
SMILES:C1=C(C)C(=O)C2c3c(cc(CCCC)cc3O)OC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.317
CB1 binding score: -15.552
InChIKey:UWFMCOHAMZAMBZ-UHFFFAOYSA-N
ID: 54721
SMILES:C(CCCc1cc(O)cc(CC=C(C)CCC=C(C)C)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.009
InChIKey:XKWLUCZAWFMDAL-UHFFFAOYSA-N
ID: 54722
SMILES:c1c(C2CO2)c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.888
InChIKey:KNKIHRYEIJUAFM-UHFFFAOYSA-N
ID: 54723
SMILES:C123C(C)CCC1C(C)(C)Oc1c2c(O)cc(C)c1O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -14.748
InChIKey:XEDJIEBNYJFGIB-UHFFFAOYSA-N
ID: 54724
SMILES:O(C)c1cc2c(cc1CCCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.443
InChIKey:ZIVQFCLGAPOZGA-UHFFFAOYSA-N
ID: 54725
SMILES:C1(C(O)=O)=C2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -15.306
InChIKey:ATKUJEIFOSDMDI-UHFFFAOYSA-N
ID: 54726
SMILES:OC(c1cc(OC)c2c(c1)OC(C)(C)C1CCC(C=O)=CC12)(O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.766
InChIKey:UJOAGICYDXHGSK-UHFFFAOYSA-N