ID: 54202
SMILES:O(c1c2c(ccc1)OC(C)(C)C1CCC(C)=CC12)C1C(O)C(O)C(O)C(CO)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.475
CB1 binding score: -16.125
InChIKey:BELPNGDVBJAPRP-UHFFFAOYSA-N
ID: 54203
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CCC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.59
CB1 binding score: -17.849
InChIKey:NYPREZZASVIFAE-UHFFFAOYSA-N
ID: 54204
SMILES:C(CCC)Cc1ccc2c(c1O)C1C(C3C(C)(C)C(C)(CC3)C1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.245
InChIKey:ZURJDGYDMUFECX-UHFFFAOYSA-N
ID: 54205
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 54206
SMILES:C(C(c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1O)CO)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.796
InChIKey:QAEXVLBZVQVHJT-UHFFFAOYSA-N
ID: 54207
SMILES:C1(C)C(OC(C)=O)c2c(O)cc(CCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.321
CB1 binding score: -12.177
InChIKey:MERMFWSDZCSPGX-UHFFFAOYSA-N
ID: 54208
SMILES:C(C1=CCC(C(=O)CCC(CC(O)CC(=CCc2c(O)c(C)cc(OC)c2)C)C)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -12.017
InChIKey:DVUZJBDPXUGDKE-UHFFFAOYSA-N
ID: 54209
SMILES:C1(O)(C)CCC(OC(=O)C=C(C)C)C(C)(C)OC1c1cc(CCCCC)cc(OC(CCCCCCC)=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.773
CB1 binding score: -15.1
InChIKey:QWQFCIZPFLNGPL-UHFFFAOYSA-N
ID: 54210
SMILES:O=[N+](c1ccc2c(c1)OC(C)(C)C1CCC(C)=CC12)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.34
CB1 binding score: -16.765
InChIKey:JMAGQRLIOZOWRE-UHFFFAOYSA-N
ID: 54211
SMILES:c1c(O)c(C=O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.043
InChIKey:ZGWQXGIHSWYNTI-UHFFFAOYSA-N
ID: 54212
SMILES:C(C1C(C)CC(CCC=C(C)C)=CC1)(CCCC(=CCc1c(O)c(C)cc(O)c1)C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -13.801
InChIKey:PIGDLXXKKMDXTN-UHFFFAOYSA-N
ID: 54213
SMILES:C1(=O)C(C)=CC2C(C(C)(C)Oc3c(C(=O)C(C)C)c(O)cc(C)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.6
InChIKey:DHBNCPUAWCLGGB-UHFFFAOYSA-N
ID: 54214
SMILES:c12cc3c(cc(CCCCC)c-3c(C(OC)=O)c(C)c1)OC(C)(C)C2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -14.625
InChIKey:UCRVJDDNXLPRPJ-UHFFFAOYSA-N
ID: 54215
SMILES:CCC=CCc1c(C(O)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.234
InChIKey:GTEHEXWEPLDDIJ-UHFFFAOYSA-N
ID: 54216
SMILES:C1CC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54217
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(c(O)cc(CCCCC)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 54218
SMILES:O=C(C)Oc1c2c(cc(CCCCC)c1)OC1(C(C)C(O)C(=O)C(C(CC(OC)=O)C)C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.594
CB1 binding score: -12.36
InChIKey:NERSDVGKHUHTIC-UHFFFAOYSA-N
ID: 54219
SMILES:O=C1c2c(c(CCCCC)cc(O)c2)CC(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.642
InChIKey:REMFOKBFUKACHP-UHFFFAOYSA-N
ID: 54220
SMILES:C1(O)C2(C)CC3C(C(C)(C)Oc4c3c(O)cc(CCCCC)c4)C(O)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.166
InChIKey:VMBJOEUTYZBVIX-UHFFFAOYSA-N
ID: 54221
SMILES:C(CCCC(O)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.051
InChIKey:IAGKLWNLNBKHND-UHFFFAOYSA-N
ID: 54222
SMILES:c1(C)c2c(c(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.272
InChIKey:KJXXHVGZVBIZNR-UHFFFAOYSA-N