ID: 44164
SMILES:C1(=O)C(C(C)C)=CC(=O)C2=C1OC1(C)CCC3C(C)(CCC4C(C)(C)Oc5cc(O)cc(C)c5C34)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.667
CB1 binding score: -15.937
InChIKey:OMMPAEDLLATIRW-UHFFFAOYSA-N
ID: 44165
SMILES:C1C2(C)CCC3C(C)(C)Oc4c(c(O)cc(CCCCC)c4)C3C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.995
InChIKey:NQPDAGNCYMHGLP-UHFFFAOYSA-N
ID: 44166
SMILES:COc1c(C2C(C(C)=C)CCC(C)=C2)cccc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.754
InChIKey:BPKVPHCRXMFJSH-UHFFFAOYSA-N
ID: 44167
SMILES:C(CC(C)=CCc1c(O)c(CC=C(C)C)cc(O)c1)CC(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.797
InChIKey:NFGWMAIOZZMIDL-UHFFFAOYSA-N
ID: 44168
SMILES:Oc1c2c(c(C=O)c(CCCCC)c1)OC(C)(C)C1CC(O)C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.358
InChIKey:NJEBKUBFQSNXOQ-UHFFFAOYSA-N
ID: 44169
SMILES:CCCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 44170
SMILES:C(CCC)CCC12c3c(OCc4ccccc4)cc(CCCCC)cc3OC(C)(C)C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.772
CB1 binding score: -16.879
InChIKey:DCPWSIGKUDZGDY-UHFFFAOYSA-N
ID: 44171
SMILES:C1C2(C)CCCC(C)C2(O)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.432
InChIKey:XAPPRTFNWOFFQS-UHFFFAOYSA-N
ID: 44172
SMILES:CC1(C)Oc2cc(O)cc(CCCCC)c2-c2c(O)cc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.993
InChIKey:ADVBXBSNUSMYGQ-UHFFFAOYSA-N
ID: 44173
SMILES:C(c1cc(OC)c(C2C(C(C)=C)CCC(C)C2)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.927
InChIKey:DIGBRLOEZYTYLT-UHFFFAOYSA-N
ID: 44174
SMILES:c1(CCCC(C)=CCc2c(C)cc(O)c(C)c2O)=CC(=O)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.027
InChIKey:CENZZERNLZVJTR-UHFFFAOYSA-N
ID: 44175
SMILES:C=C(C)C1CCC(C)=CC1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 44176
SMILES:Oc1c(C(CC(C)=O)C)c(O)c2c(c1)OC(C)(C)C1CC=C(C=O)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -13.28
InChIKey:AKICJSVNDCOGNC-UHFFFAOYSA-N
ID: 44177
SMILES:C(C)CCCc1cc2c(c(OC)c1)C1C(C)(O2)CCC2C(C)(C)CC3C(C)CC(OC)C13C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -14.892
InChIKey:AMPQMCLUVBNBJW-UHFFFAOYSA-N
ID: 44178
SMILES:C1(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 44179
SMILES:C(C(C(C)(C1=CC(=O)C2=C(C1=O)OC1(C)CC3C(C(=C)C)CC13C(C)=CC2)C)=O)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -16.66
InChIKey:LINFFPGODXENKV-UHFFFAOYSA-N
ID: 44180
SMILES:C(C(=CC)C)=C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -17.134
InChIKey:ZIHLCOQQCAIHOH-UHFFFAOYSA-N
ID: 44181
SMILES:c12cc(C)ccc1C(C)(C)Oc1cc(CCCCC)c(C(=O)CC(C)C)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.288
InChIKey:SMEXLJUCHVIOLV-UHFFFAOYSA-N
ID: 44182
SMILES:O1c2cc(CCCC)cc(O)c2C2C1(C)CCC2C(C)(C#N)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.441
CB1 binding score: -18.039
InChIKey:JQCBGRAVVBHZOM-UHFFFAOYSA-N
ID: 44183
SMILES:C(c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)CC21)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.019
InChIKey:YZEDYKZHDHSNPT-UHFFFAOYSA-N
ID: 44184
SMILES:O(c1cc(CCCCC)cc2c1OC(C)(C)C1=C2CC(C)CC1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.909
InChIKey:CQQRFTUMAZPQMY-UHFFFAOYSA-N