ID: 123145
SMILES:C(Cc1cc(C(O)=O)cc2c1OC(C)(C)C1=C2CC(C)(C)C1=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.554
InChIKey:JLDKEHCHIHJNCV-UHFFFAOYSA-N
ID: 123146
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(C(=C)C=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.532
InChIKey:AJRZNBRQRYACQR-UHFFFAOYSA-N
ID: 123147
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 123148
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCCO)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 123149
SMILES:C1C(C)=CC2c3c(cc(CCCC)cc3O)OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.182
InChIKey:OCKHYBZGEWTKPC-UHFFFAOYSA-N
ID: 123150
SMILES:c1(CC=C(CCC=C(C)C)C)cc(CCCC=C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.397
InChIKey:ZBBPYUOVLCWJEN-UHFFFAOYSA-N
ID: 123151
SMILES:C(CC)C(=O)Oc1cc2c3c(c1O)OC(C)(C)C1C3C=C(C)CCC13C(C)=CCCC23
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -15.306
InChIKey:KLESIRFQPMHLGS-UHFFFAOYSA-N
ID: 123152
SMILES:c1(C)cc2c(c(O)c1)C1C=C(C(=O)O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.944
InChIKey:GITSDXGASNCATJ-UHFFFAOYSA-N
ID: 123153
SMILES:C12C3c4c(O)cc(CCCCC)cc4OC(C)(C)C3CCC(C)(C1)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -13.842
InChIKey:ZOWZDLHOVMCUBI-UHFFFAOYSA-N
ID: 123154
SMILES:C1(C)(C)Oc2c(c(OC)cc(CCCCC)c2)C2C1C(O)C(O)CC2(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.509
CB1 binding score: Not available
InChIKey:YAHYWQZTKUUFOO-UHFFFAOYSA-N
ID: 123155
SMILES:C(C1CCC(C)(C)C1c1c(O)c(Oc2cc(CCCCC)cc(O)c2)cc(C)c1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.027
InChIKey:NJNMLKACFKMLNZ-UHFFFAOYSA-N
ID: 123156
SMILES:c1([N+](=O)O)c(C)c(OC)c(OC2(C(C)C)CCC(C)=CC2)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.63
CB1 binding score: -14.347
InChIKey:QMRVSQJPYUOMIO-UHFFFAOYSA-N
ID: 123157
SMILES:C12(Cc3c(cc(CCCCC)cc3OC)O1)C(O)CCC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -12.951
InChIKey:XIGLLFCTKZXFBI-UHFFFAOYSA-N
ID: 123158
SMILES:C(Cc1c(O)c(C=O)c(O)c(C2C=C(C)CCC2C(C)=C)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.19
InChIKey:AHIWSLRSLDLVEC-UHFFFAOYSA-N
ID: 123159
SMILES:C1(C)(C)C2CCC(C(=O)O)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 123160
SMILES:c12cc(C)c(O)c(OC)c1C=CC(C)(CCC=C(C)CC=CC(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -16.451
InChIKey:WZFNJKVKIMHBFT-UHFFFAOYSA-N
ID: 123161
SMILES:C(=C(C)C)C(=O)c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c(C(C(C)CC)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -15.673
InChIKey:VUPNTHGIMWMZEO-UHFFFAOYSA-N
ID: 123162
SMILES:C12OC3(C(C)CCC4OC(C)(C)OC(C)(C)C4C13)c1cc(O)c(C)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -16.42
InChIKey:VOUAEBHCUCZGEW-UHFFFAOYSA-N
ID: 123163
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.339
CB1 binding score: -16.789
InChIKey:WGHPRUXKZYPHBV-UHFFFAOYSA-N
ID: 123164
SMILES:O(C)c1c(C)c(OC(C)=O)c(C2C=C(C)CCC2C(C)=C)c(O)c1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.432
InChIKey:HHGCDYZFOPUZED-UHFFFAOYSA-N
ID: 123165
SMILES:O(C)C1c2c(O)c(O)cc(CCCCC)c2C2C(C(C)(C)O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.35
InChIKey:XTZNBJZGJXEZSB-UHFFFAOYSA-N