ID: 49183
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 49184
SMILES:C1C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.78
InChIKey:NROBKQHQUVSAAS-UHFFFAOYSA-N
ID: 49185
SMILES:C12=C(COC1=O)C1COC(c3c(cc(CCCCC)cc3OC)O1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.929
InChIKey:MTOIJRIGILNWSG-UHFFFAOYSA-N
ID: 49186
SMILES:C12(Oc3cc(O)c(CC=C(C)CCC=C(C)C)c(O)c3)Oc3c(c(O)cc(CCCCC)c3)C1C=C(C)CCC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.748
CB1 binding score: -15.697
InChIKey:JLCQKIWNDGWNQB-UHFFFAOYSA-N
ID: 49187
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2C1CCC1(C)OC1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.669
InChIKey:URFUBVWFRCWAIL-UHFFFAOYSA-N
ID: 49188
SMILES:C(CCCC)c1cc(O)c2c(c1C(O)=O)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.636
InChIKey:VKFFKPSFOREJKS-UHFFFAOYSA-N
ID: 49189
SMILES:C1C2(C)c3c(cc(C)cc3O)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.064
InChIKey:BSWGLBUIISKILG-UHFFFAOYSA-N
ID: 49190
SMILES:C1(=C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 49191
SMILES:CC1CC(C=C(C)C)CC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.908
InChIKey:GXVUIEMIEOCMGY-UHFFFAOYSA-N
ID: 49192
SMILES:C(C12C(C3c4c(O)cc(CCCCC)cc4OC3(C)CCC1OC(=O)C)C(C)(C)O2)(=C)Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 463.014
CB1 binding score: -13.798
InChIKey:HMITZPWUMYHJIF-UHFFFAOYSA-N
ID: 49193
SMILES:c1(CC(C)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.315
InChIKey:WTRKRGRMUBVMKA-UHFFFAOYSA-N
ID: 49194
SMILES:c1c(O)c2c(c(CC=C(C)CCC=C(C)C)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.736
InChIKey:WECGBJFHZFCNBA-UHFFFAOYSA-N
ID: 49195
SMILES:c1(O)cc(CCCCC)c(N=C(O)C=C(CCC=C(C)C)C)c(O)c1Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 379.928
CB1 binding score: -15.21
InChIKey:WQVHEKBARVBLRM-UHFFFAOYSA-N
ID: 49196
SMILES:C(C1(C)C2C(c3c(cc(CCCCC)cc3O)O1)CC(C)=CC2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.979
InChIKey:BGFAVKWESQHCHC-UHFFFAOYSA-N
ID: 49197
SMILES:CC12CCCC(C)=C1C(=O)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.672
InChIKey:GYRVEZCEKBTHDV-UHFFFAOYSA-N
ID: 49198
SMILES:C1(C)=CC(c2c(O)c(C(=O)O)c(CCC)cc2O)CC1(CCC=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.01
InChIKey:UQTPTMVRBQNYHL-UHFFFAOYSA-N
ID: 49199
SMILES:C(Cc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)cc1)Cl
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.834
CB1 binding score: -14.558
InChIKey:NWHRYQZLPQCCBA-UHFFFAOYSA-N
ID: 49200
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC1CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.966
InChIKey:LNLAUTXXFFANRA-UHFFFAOYSA-N
ID: 49201
SMILES:C(=CCCC)COC(=O)c1c(O)cc2c(c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.441
InChIKey:NYQKEZYCVCTQIT-UHFFFAOYSA-N
ID: 49202
SMILES:C(CCCc1cc(O)c(C2C(C(C)=C)CC=C(C)C2)c(O)c1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.002
InChIKey:VAPPSCCITXAWIQ-UHFFFAOYSA-N
ID: 49203
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC2C(=C)CCC1C(=C)C2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.653
CB1 binding score: -14.748
InChIKey:PTWGKFWNAVGPSS-UHFFFAOYSA-N