ID: 53467
SMILES:C(CC(O)Cc1c(O)c2c(c(C(=O)C(CC)C)c1O)OC(C)(C)C1C2C(O)(C)CC1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -16.038
InChIKey:PUDZNGGMRCKLAC-UHFFFAOYSA-N
ID: 53468
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1(O2)CCC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.122
InChIKey:CNEQLGAKZYIREA-UHFFFAOYSA-N
ID: 53469
SMILES:c1(CO)cc(O)c2c(c1C(=O)C=CC)OC(C)(C)C1CCC(=C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.718
InChIKey:UWEJRHCSRYAFNO-UHFFFAOYSA-N
ID: 53470
SMILES:C1=C(C)CC2c3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 53471
SMILES:C1C(C)=CC2C(C1)C(C)(C)Oc1c2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 53472
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 53473
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)c(C(=O)OC)c(CCCCC)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -16.349
InChIKey:NQHPCKANHGPLFT-UHFFFAOYSA-N
ID: 53474
SMILES:C12C(O)(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.769
InChIKey:YKQWTCZDXOFGFC-UHFFFAOYSA-N
ID: 53475
SMILES:C1C(C(=O)O)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.994
InChIKey:YZKMXNYCASDHEX-UHFFFAOYSA-N
ID: 53476
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.023
InChIKey:AUSUIGFPHFBARQ-UHFFFAOYSA-N
ID: 53477
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53478
SMILES:CC1=Cc2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.43
InChIKey:XKTKRSYUASYBTB-UHFFFAOYSA-N
ID: 53479
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 53480
SMILES:C1CCC2(C)C3C(C4OC3C2(C)Oc2cc(CCCCC)cc(O)c2O4)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.184
InChIKey:HHKMJPMGFDEGNV-UHFFFAOYSA-N
ID: 53481
SMILES:C(C)(=C)CC(OCC12Oc3c(c(O)cc(CCCCC)c3)C1(C)CC(OC(C(C)=CC)=O)C1(C)C(C)(C)CCC=C21)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.79
CB1 binding score: -14.55
InChIKey:FFGMLNHCTJWAGY-UHFFFAOYSA-N
ID: 53482
SMILES:C(C)C(C)=CC(CC(CCC)C)c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -12.258
InChIKey:WQDLFVXEJJFMFA-UHFFFAOYSA-N
ID: 53483
SMILES:O=C(CC1(C)Oc2cc(CCC)cc(O)c2C1)C=CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.383
InChIKey:YWTQBLQSSIWYSK-UHFFFAOYSA-N
ID: 53484
SMILES:O=C(C1=CCC2c3c(cc(CCCCC)cc3O)OC(C1)C2(C)C)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.911
InChIKey:MHEVKELCROYINC-UHFFFAOYSA-N
ID: 53485
SMILES:Cc1cc2c(c(OC)c1)C(=O)C(C)(CC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -15.32
InChIKey:FNJOZZWTHADWMW-UHFFFAOYSA-N
ID: 53486
SMILES:C(CCC)Cc1cc(O)c2c(c1O)C1(C=C(C)C)OCC2C(=O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.765
InChIKey:RYQKKZQBRVACQO-UHFFFAOYSA-N
ID: 53487
SMILES:C1(C)=CCCC(C)=CC2C(CC1)C(C)(C)Oc1cc(CC=C)cc(c1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -19.197
InChIKey:SOTXVCIVMVQVKX-UHFFFAOYSA-N