ID: 31900
SMILES:OC1(C)CCC2c3c(O)cc(CCCCC)cc3OC2(C)CC=CC(C)(C)CC=C(CO)C(=O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -16.534
InChIKey:DMNFRCLTKJXTHH-UHFFFAOYSA-N
ID: 31901
SMILES:C(CCCCCC)Cc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)c-2c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -15.067
InChIKey:XANLNFMSKFELNE-UHFFFAOYSA-N
ID: 31902
SMILES:C(C)(=CC(c1c2c(c(O)cc1C)OC(C)(C)C1C2C=C(C(OC)=O)CC1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.513
InChIKey:WVTMFXXAHLNRMJ-UHFFFAOYSA-N
ID: 31903
SMILES:C(=C(C)C)C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1CC=C(CCC=C(C)C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -16.502
InChIKey:RPBNXWYENUPPID-UHFFFAOYSA-N
ID: 31904
SMILES:C1(C(O)(C)C)CCC(C)(C2C3C(C)(CC2)O3)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -12.863
InChIKey:INNXJHUHKKXWPR-UHFFFAOYSA-N
ID: 31905
SMILES:C=C(C)C1C(c2c(OC)cccc2CCCC)cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -14.353
InChIKey:UEKLTMSAOYYBMI-UHFFFAOYSA-N
ID: 31906
SMILES:C(C)(=CCCC(C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 31907
SMILES:C1=C(C)CCC2C(CO)(C)Oc3cc(CCc4ccccc4)cc(O)c3C12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 364.485
CB1 binding score: -15.98
InChIKey:QFSNDDDICVOVCF-UHFFFAOYSA-N
ID: 31908
SMILES:Oc1cc(CCCCC)cc(O)c1C1C=C(CCC=C(C)C)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.854
InChIKey:ZGNBDHDIIXUCDX-UHFFFAOYSA-N
ID: 31909
SMILES:c1(CC=C(CCC=C(C)C)C)c(CCCCC)cc(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 31910
SMILES:C(Cc1cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)c(O)c1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.654
InChIKey:MXPMJEYZLVXDEG-UHFFFAOYSA-N
ID: 31911
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.329
InChIKey:OGTYERSWJNGKFK-UHFFFAOYSA-N
ID: 31912
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(OC(C)=O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 31913
SMILES:Oc1c(CCCCC)cc2c(c1O)C1C3(C(C)(C)O3)OC(C)(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.575
InChIKey:RUMMARXPODEFTN-UHFFFAOYSA-N
ID: 31914
SMILES:c1c(C(C)=CC(=O)CC(C)C)c(O)cc2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -17.29
InChIKey:IMJPPCOVZIMMBV-UHFFFAOYSA-N
ID: 31915
SMILES:c1(CC(C)C2CC=C(C)CCC=C(C)C2)cc(O)c(CC=C(C)C)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.275
InChIKey:POXMBYADCNNVQY-UHFFFAOYSA-N
ID: 31916
SMILES:c1(CCCCC)cc2c(c(O)c1C(OC)=O)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -17.837
InChIKey:WXUIBYPBAKIMIT-UHFFFAOYSA-N
ID: 31917
SMILES:Oc1c(C(=O)CC(C)C)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.53
InChIKey:NROYKMSGPAXRQS-UHFFFAOYSA-N
ID: 31918
SMILES:CC1(C)Oc2c(c(O)cc(CC=C)c2)C2CC(C)(O)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.966
InChIKey:XDGXIVNNCSTIPU-UHFFFAOYSA-N
ID: 31919
SMILES:C(Cc1c(I)cc2c(c1C)OC(C)(C)C1CC=C(C)CC21)(O)C(O)C(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.39
CB1 binding score: -14.952
InChIKey:JWOQLPHCAJQRGL-UHFFFAOYSA-N
ID: 31920
SMILES:C(c1cc(O)c2c(c1O)OC(C)(C)C1C2C(O)CC1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.709
InChIKey:NQRZTEOCHTWEEI-UHFFFAOYSA-N