ID: 82888
SMILES:C12(C)C(OC(C)=O)CC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C3C1C(C)=CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.929
InChIKey:JOESCUUCSILDSW-UHFFFAOYSA-N
ID: 82889
SMILES:c12c(c(O)cc(CCCC)c1)C1=C(C(C)(C)O2)CC2(C(C)=CC(O)C(C(C)(C)O)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.726
InChIKey:OHKKYBFKISVKON-UHFFFAOYSA-N
ID: 82890
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 82891
SMILES:C12C3(c4c(O)cc(CCCCC)cc4OC3(C)C)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.932
InChIKey:NWZGEQUETDDGSV-UHFFFAOYSA-N
ID: 82892
SMILES:C1C2OC3(C)CC1c1c(O)cc(CCCCC)cc1OC23
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.643
InChIKey:WTMQWWAPLLDUTH-UHFFFAOYSA-N
ID: 82893
SMILES:C(c1cc2c(c(O)c1)C1C=C(C)C(O)CC1C(C)(C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.697
InChIKey:RDLUNEDCJHKYDQ-UHFFFAOYSA-N
ID: 82894
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(CCCC(C)C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -17.123
InChIKey:NEKOVRDYZAVUFY-UHFFFAOYSA-N
ID: 82895
SMILES:C(CCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 82896
SMILES:N(CCc1cc(O)c2c(c1)OC(c1ccccc1)CC2O)C=CC(O)C(C(CC)CC(C)CC)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 483.649
CB1 binding score: -14.393
InChIKey:KOEOSJZGDKEAQC-UHFFFAOYSA-N
ID: 82897
SMILES:O1C2(C)CCC3C(C)(C)Oc4c(c(O)cc(CCC)c4C3=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.082
InChIKey:DSAUKABMOARMDO-UHFFFAOYSA-N
ID: 82898
SMILES:C(CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.261
InChIKey:RJVIXPLBEVWIFK-UHFFFAOYSA-N
ID: 82899
SMILES:Cc1c(C)c(CCCCC)c(C(=O)O)c2c1CC(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.469
InChIKey:VOJZOZPUOUCOSW-UHFFFAOYSA-N
ID: 82900
SMILES:C(=O)C1=CC2C(C(C)(C)OC(=O)C2=C(C(CC)C)OC(=O)C)C(OC(=O)C)CC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.567
CB1 binding score: -15.374
InChIKey:PLRZKADACXLLTB-UHFFFAOYSA-N
ID: 82901
SMILES:C12C3(C)C(C)(CC1c1c(O)cc(CCCC)cc1O2)C1(C)CCC=C(CCC=C(C)C)C1CC3O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.717
CB1 binding score: -15.358
InChIKey:QBBCIFNMZKKSIS-UHFFFAOYSA-N
ID: 82902
SMILES:c1(C(C)C)c2cc(C)cc(O)c2c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.502
CB1 binding score: -15.228
InChIKey:SZOWKVHYJIDYFZ-UHFFFAOYSA-N
ID: 82903
SMILES:C1=C(C)CCC(C(=C)C)=C1c1c(O)cc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -15.804
InChIKey:UZWPMWILMMHRNC-UHFFFAOYSA-N
ID: 82904
SMILES:O(c1c(OC)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -19.512
InChIKey:XSVIAZSLVNZZSQ-UHFFFAOYSA-N
ID: 82905
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 82906
SMILES:OC1C(C(C)C)CCC2(C)Oc3c(c(OC)cc(CCCCCC[N+](C)(O)C)c3)CC2C(C(OC)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.715
CB1 binding score: -16.982
InChIKey:BFUPNMKMEIAISL-UHFFFAOYSA-N
ID: 82907
SMILES:C1(c2c(O)cc(CCCCC)cc2)OC(C(O)(C)C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -16.29
InChIKey:LRVGIWLWARUWAR-UHFFFAOYSA-N
ID: 82908
SMILES:C12Oc3c(ccc(CCCCC)c3O)C3C1C(C(C)=CC3=O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.427
InChIKey:XXIJZWNCJMTBEV-UHFFFAOYSA-N