ID: 94018
SMILES:O=C(Oc1cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.821
InChIKey:ZVINARQMVDEGGG-UHFFFAOYSA-N
ID: 94019
SMILES:C1(c2c(O)cc(CCCCC)cc2)C(C(C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 94020
SMILES:C(C=Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2)(O)(C)C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.735
InChIKey:ONXNRDIMNNTBCP-UHFFFAOYSA-N
ID: 94021
SMILES:CC1(C)c2c(ccc(C)c2)-c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.213
InChIKey:ABQUTLCPMMOSHA-UHFFFAOYSA-N
ID: 94022
SMILES:C(C)(CCCc1cc2c(cc1O)OC1(C)C(C2)C(C(O)(C)C)CC1)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -14.545
InChIKey:WSLPUJTTWYAKQS-UHFFFAOYSA-N
ID: 94023
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C2C(C)(CC1)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.015
InChIKey:HESNUMLBEXPOKA-UHFFFAOYSA-N
ID: 94024
SMILES:C1C2C3C(C(CC(=O)C)(C)CC(C(C)=C)C2)c2c(cc(CCCCC)cc2O)OC3(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -16.813
InChIKey:SLPBKVITMLXQIF-UHFFFAOYSA-N
ID: 94025
SMILES:c1(C(=O)O)cc2c(cc1)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.038
InChIKey:UUOAKXZPWRBWNL-UHFFFAOYSA-N
ID: 94026
SMILES:CC1(C)CC2(O)Oc3c(c(O)cc(CCCCC)c3)C3C2C1C3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.981
InChIKey:IVIVCTJZRRZCNJ-UHFFFAOYSA-N
ID: 94027
SMILES:C1(c2c(O)cc(CCCCC)cc2)C(C)(C)C2=C(C1=O)C1CC(C(C)(C)O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.386
InChIKey:WVUOQVDVDWBZIA-UHFFFAOYSA-N
ID: 94028
SMILES:c12c(cc(O)cc1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.912
InChIKey:JKUWZILTAIFPQY-UHFFFAOYSA-N
ID: 94029
SMILES:C(C)CCc1cc(O)c(Cc2c(O)cc(O)c3c2OC(C)(C)C2CCC(C)(O)CC32)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -14.638
InChIKey:FRSMFMDQBVIOLZ-UHFFFAOYSA-N
ID: 94030
SMILES:C1(C)=CCC2C(c3c(O)cc(CCCCC)cc3OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 94031
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 94032
SMILES:CC1(C)Oc2cc(O)cc(C)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.409
InChIKey:BJMZVRMKKMPCLN-UHFFFAOYSA-N
ID: 94033
SMILES:C(CC=C(C)Cc1c(O)c(C(OC)=O)c(CCCC)cc1O)=C(C(O)CC=C(C)CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -15.633
InChIKey:HLMALLYSBIDIEV-UHFFFAOYSA-N
ID: 94034
SMILES:c1(C)cc(OCCOCCC(CC)O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -18.017
InChIKey:OUCHBGIUFUGSIU-UHFFFAOYSA-N
ID: 94035
SMILES:C(C1=CCCC2C1(C)C1C(CC2=O)c2c(O)cc(C)cc2O1)(OC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.42
InChIKey:RYYPLLRPIMLLKH-UHFFFAOYSA-N
ID: 94036
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)(CCC=C(C)C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -19.284
InChIKey:GJHUUCABDYFFDB-UHFFFAOYSA-N
ID: 94037
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 94038
SMILES:C12CC=C(C)CC1c1c(O)cc(CCOC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -13.39
InChIKey:VIWRVOPBJKJHID-UHFFFAOYSA-N