ID: 41182
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C3C(C)(CCC1(C)C)C(C2)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.513
InChIKey:OFEFQCWJJSZARK-UHFFFAOYSA-N
ID: 41183
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(OC)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -16.167
InChIKey:QYJGHZXOIWLFTA-UHFFFAOYSA-N
ID: 41184
SMILES:c1(CCCCCC)cc2c(c(O)c1)OC(CCC=C(CCC=C(C)C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.015
InChIKey:RXEWTJZYVKCNPC-UHFFFAOYSA-N
ID: 41185
SMILES:O1C2C3C(c4c(cc(CCCCC)cc4O)OC13C)C(O)C2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.029
InChIKey:YFSHNIXMFKDINQ-UHFFFAOYSA-N
ID: 41186
SMILES:c1(CCCCCC)cc2c(c(OC)c1)OC(C)(CCC1C(C)(C)O1)CCC=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.143
InChIKey:LNBKTRFCVAGXSU-UHFFFAOYSA-N
ID: 41187
SMILES:C1(C)(O)CCCC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.807
InChIKey:FHLPURFQICSTBW-UHFFFAOYSA-N
ID: 41188
SMILES:O=C(OC)c1c(CCCCC)ccc2c1OC(C)(C)C1C2CC(=O)C2(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.151
InChIKey:WFIKELZRFHCDDQ-UHFFFAOYSA-N
ID: 41189
SMILES:C1=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.109
InChIKey:BDIDINQIQBAQEK-UHFFFAOYSA-N
ID: 41190
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.994
InChIKey:RSHHRAXMOZULOO-UHFFFAOYSA-N
ID: 41191
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: 41192
SMILES:C(SC(C(O)=O)CC)(CCC(=CCCC(C)=CCc1c(O)c(C)cc(OC)c1)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.614
CB1 binding score: -16.883
InChIKey:CVKKLNIMICHSFI-UHFFFAOYSA-N
ID: 41193
SMILES:C(C=C(C)C)CC(=CC(O)C1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.633
InChIKey:JBLFLGJTHRADGN-UHFFFAOYSA-N
ID: 41194
SMILES:C=C(C)C1C(c2c(O)cc(CCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.289
InChIKey:UJQVSFLXIHFWCQ-UHFFFAOYSA-N
ID: 41195
SMILES:C12(C)Oc3c(c(O)c(C(=O)OC)c(CCCCC)c3)C(C1(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.093
InChIKey:ASPAJVNFQGTLJK-UHFFFAOYSA-N
ID: 41196
SMILES:Oc1c(C(O)=O)c(CCCC)cc2c1-c1c3c(c(C)cc1)C(C)=CCC3C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -13.737
InChIKey:DFHAVVVVUHVFLT-UHFFFAOYSA-N
ID: 41197
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)c(C(=O)O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 41198
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(C)C=CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.32
InChIKey:WWYMYGIVLCKTBL-UHFFFAOYSA-N
ID: 41199
SMILES:C1(O)C2C(C)(C(C)(O)CCC2CC(C)(C)O)Oc2c1c(O)c(C(=O)OCC)c(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -15.929
InChIKey:CILIWQCUJXCAMP-UHFFFAOYSA-N
ID: 41200
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(C(=O)C)CCC(C)(C)C1=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.932
InChIKey:OJPOBSWIVGPSSX-UHFFFAOYSA-N
ID: 41201
SMILES:CC1(C)C2C(c3c(cc(CCCCC)c(C=O)c3O)O1)CCC(C(O)=O)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.605
InChIKey:DBINBFJKYYCGDC-UHFFFAOYSA-N
ID: 41202
SMILES:C(CC1(C)Oc2c(c(O)c(C)c(OC(C)=O)c2)C(C=CC(C)(O)C)C=C1C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.502
InChIKey:ZSRUZHKTPHIGTN-UHFFFAOYSA-N