ID: 96097
SMILES:c1(O)c(=O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.482
InChIKey:PZUWOZASFQSPQY-UHFFFAOYSA-N
ID: 96098
SMILES:C1(Cl)C(C)(CCC(O)C(=C)C)CC(c2cc(C=O)ccc2O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.924
CB1 binding score: -17.442
InChIKey:DOEKDUHJXUISLI-UHFFFAOYSA-N
ID: 96099
SMILES:c1(O)cc(CCC)c(O)c2c1C1CC(C)(O2)C2CC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -11.858
InChIKey:GIGPZDJTZZIMGT-UHFFFAOYSA-N
ID: 96100
SMILES:C(CCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.188
InChIKey:GGHRHCGOMWNLCE-UHFFFAOYSA-N
ID: 96101
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2c1c1c(c(C)c(O)cc1)cc2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.496
CB1 binding score: -15.625
InChIKey:UJWFDTLXUPOMHV-UHFFFAOYSA-N
ID: 96102
SMILES:CC(CCC(OCC1C2(C)C(CC=C1COC(=O)CCc1cc(O)c(O)cc1)OC(C)(C)CC2)(O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.691
CB1 binding score: -16.776
InChIKey:KNINZVBDDONLEC-UHFFFAOYSA-N
ID: 96103
SMILES:C(C1C(C)=CC2c3c(O)c(C(O)=O)c(CCCCC)cc3OC(C)(C)C2C1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.225
InChIKey:HYSAPUCNONVJQV-UHFFFAOYSA-N
ID: 96104
SMILES:C(CCC)CCCCc1c2c(cc(C(O)=O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.153
InChIKey:OOKQWUJUJWACBO-UHFFFAOYSA-N
ID: 96105
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 96106
SMILES:C1CC(C)=C(C)CC1c1c(OC)ccc(CCCCC)c1Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.904
CB1 binding score: -13.986
InChIKey:PUVSFXATUJYUMT-UHFFFAOYSA-N
ID: 96107
SMILES:C(CCC)Cc1cc(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: 96108
SMILES:Oc1cc(C(O)=O)cc2c1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -16.353
InChIKey:ZNSOCQGMRLSTPR-UHFFFAOYSA-N
ID: 96109
SMILES:Oc1cc(CCCC)cc2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -19.932
InChIKey:YRIJETKCLFDWJX-UHFFFAOYSA-N
ID: 96110
SMILES:C1=C(C)CCC2C(C)(C)SC12c1c(CCCCC)cc(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.536
CB1 binding score: -15.789
InChIKey:VLUAHZRIUDHOSO-UHFFFAOYSA-N
ID: 96111
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CCC(CO)=CC1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.544
InChIKey:XRCPUZLKBNGNRR-UHFFFAOYSA-N
ID: 96112
SMILES:C1C(C)c2c(c(O)c(C)cc2O)OC(C)(CCC=C(CO)CCC=C(C)C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.943
InChIKey:CJXVDABNTHNKCI-UHFFFAOYSA-N
ID: 96113
SMILES:Oc1cc(O)c(=O)c(C(CC(C)C)=O)c2c1C1C(C(C)(C)O2)CC=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -16.033
InChIKey:YCDYLTPWJUCSDH-UHFFFAOYSA-N
ID: 96114
SMILES:C(CCC(C)=CCc1c(O)cc(CCC)cc1O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 96115
SMILES:C(=O)(C)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 96116
SMILES:C1CC2(C(O)C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.064
InChIKey:ZIZLKEARFGDLNJ-UHFFFAOYSA-N
ID: 96117
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N