ID: 113968
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C(C)(C)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.942
InChIKey:PRKDRANYBPHDBW-UHFFFAOYSA-N
ID: 113969
SMILES:C12C(C)(OCC1C)Oc1c(c(CCCCC)cc(O)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids;Cyclic polyketides
Class: Cannabinoids;Fungal cyclic polyketides (Miscellaneous)
MW: 290.403
CB1 binding score: -16.867
InChIKey:NZJISLLYFUNDDM-UHFFFAOYSA-N
ID: 113970
SMILES:C12C(OC(C(CC)(C)C)=O)C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -13.113
InChIKey:DEMJBWLAEWUXGH-UHFFFAOYSA-N
ID: 113971
SMILES:c1c(CCCCC)cc2c(c1O)OC1(C)CCCC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.298
InChIKey:BXDONIIVZXTLCN-UHFFFAOYSA-N
ID: 113972
SMILES:CC1=CC(c2c(O)cc(CCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 113973
SMILES:O=C1C=C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C2CC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.715
InChIKey:HYDRLVNXUUTUBY-UHFFFAOYSA-N
ID: 113974
SMILES:c1(O)c2c(ccc1CCCCC)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -16.507
InChIKey:LWALRXIQZGPAJM-UHFFFAOYSA-N
ID: 113975
SMILES:c1(OC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.737
InChIKey:VVNXRMKZONJZEP-UHFFFAOYSA-N
ID: 113976
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 113977
SMILES:C1(C)CCC(C(C)C)CC1=Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.842
InChIKey:MRILLQALEYKDTD-UHFFFAOYSA-N
ID: 113978
SMILES:C12C(C)(C)Oc3cc(cc(O)c3)C(=O)C1C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -15.105
InChIKey:KGWBDNWYXLGMOP-UHFFFAOYSA-N
ID: 113979
SMILES:C(c1c2c(c(CC=C(C)CCC=C(C)C)c(O)c1)C=CC(CO)(C)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.65
InChIKey:VTOCLLURYAEEKQ-UHFFFAOYSA-N
ID: 113980
SMILES:C1(C)=C(C)CCC2(C(c3c(O)cc(C)c4c3OC(C)(C)C(Cl)C4)OC2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.924
CB1 binding score: -14.605
InChIKey:QVLCMMULQMMIQG-UHFFFAOYSA-N
ID: 113981
SMILES:C12C(CO)(C)C2C2C(c3c(O)cc(CCCCC)cc3OC2=O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.014
InChIKey:HFDGJMPTSNHELQ-UHFFFAOYSA-N
ID: 113982
SMILES:C1C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 113983
SMILES:c1(OC(C)(C)C=C)cc(CCCCC)cc(O)c1C1C=C(C)CCC2C(C)(CCC2C(C)(O)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -15.069
InChIKey:PJJOLGSRJIMUAH-UHFFFAOYSA-N
ID: 113984
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2(O)C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.116
InChIKey:DKUVWYAGGDMRKC-UHFFFAOYSA-N
ID: 113985
SMILES:Oc1c(O)cc2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.748
InChIKey:UESOFUAUNDLWRH-UHFFFAOYSA-N
ID: 113986
SMILES:CC1C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -17.513
InChIKey:YTVWRQUVFKUKDU-UHFFFAOYSA-N
ID: 113987
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCC)cc2OC)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.172
InChIKey:ZLMHDSKDPRIBDQ-UHFFFAOYSA-N
ID: 113988
SMILES:C(C1C(O)(C)CCC(O)C1(C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -17.001
InChIKey:XFEDJLXLJQHWOI-UHFFFAOYSA-N