ID: 89965
SMILES:c1(CCC=C(CCC=C(C)C)C)c(C=O)c(O)c2c(c1)OC(C)C1CC(O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.298
InChIKey:XEYVACWKJNWXPU-UHFFFAOYSA-N
ID: 89966
SMILES:C12C(C)(C)CCCC1(C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 288.431
CB1 binding score: -18.4
InChIKey:IYJFZOBKCYBWAD-UHFFFAOYSA-N
ID: 89967
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O)C1(O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.827
InChIKey:NZVYELQCRCWNFT-UHFFFAOYSA-N
ID: 89968
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 89969
SMILES:OCc1cc(O)c(O)c2c1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -12.765
InChIKey:BKDXXEKPYCMTPG-UHFFFAOYSA-N
ID: 89970
SMILES:CC1=CC2C3=C(CC(C)CCC1)C(C)(CC(C=C(C)C)O)C(C2)Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.744
CB1 binding score: -16.724
InChIKey:IOIYDEJUTSBJCB-UHFFFAOYSA-N
ID: 89971
SMILES:C12C(C)(Oc3c(c(O)c(C(=O)O)c(CCCCC)c3)C1O)CC(O)C(C(C)(O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.518
CB1 binding score: -9.005
InChIKey:RCNBBHGDNLFKLZ-UHFFFAOYSA-N
ID: 89972
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 89973
SMILES:Oc1c(O)c(CCCCC)cc2c1C1C(C(CO)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.775
InChIKey:STSYICOSSOZAOC-UHFFFAOYSA-N
ID: 89974
SMILES:C12Cc3c(C)c4c(cc3OC1(C)C)Cc1c(cc(CCCCC)cc1O)OC2(C)CC4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -15.045
InChIKey:UWYZHFIILKNTEE-UHFFFAOYSA-N
ID: 89975
SMILES:c1(O)c2c(c(O)cc1CCCCC)OC(C)(C)c1ccc(C)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.346
InChIKey:VEIJZWNHWGNGRC-UHFFFAOYSA-N
ID: 89976
SMILES:C1CC2C(C)(C)Oc3c(c(OC)cc(CCCC)c3)C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.783
InChIKey:YVHKMFSIUJUDBD-UHFFFAOYSA-N
ID: 89977
SMILES:C(CC1(O)Oc2cc(C)c3c(c2CC1)OC(C)(C)C1CCC(COC(=O)c2ccccc2)=CC31)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.667
CB1 binding score: -13.625
InChIKey:WWOQWKMLFNGKFM-UHFFFAOYSA-N
ID: 89978
SMILES:O=C(C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 89979
SMILES:c1(CCCCC)cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.365
InChIKey:TVLUJXRPTYGDHM-UHFFFAOYSA-N
ID: 89980
SMILES:C1(C)=CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.814
InChIKey:UMIBLFYKFHHHFI-UHFFFAOYSA-N
ID: 89981
SMILES:C(CC)CCc1c(O)c2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.622
InChIKey:VUACIIASMNRNBB-UHFFFAOYSA-N
ID: 89982
SMILES:C(C)(C(O)C)=C1C(C(C2=CCCCC2=O)OC)c2cc(CCCCC)ccc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.123
InChIKey:UIAZZVGDRFNMNY-UHFFFAOYSA-N
ID: 89983
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(C)(O2)CCC1C(CCC=C(C)C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -18.518
InChIKey:PGENGASDZVELKM-UHFFFAOYSA-N
ID: 89984
SMILES:C(NC(PC1CC2C(c3c1cc(CCCCC)cc3)OC(C)(C)C2O)=O)(Cc1ccccc1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 495.644
CB1 binding score: -15.663
InChIKey:VFZZZIQEWSNPNB-UHFFFAOYSA-N
ID: 89985
SMILES:C(C)(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N