ID: 46873
SMILES:C1(CCC=C(C)C)(COC(=O)C)C=Cc2c(O)c(C(=O)O)c(CCC)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -12.934
InChIKey:GWWQOALIAYKOLD-UHFFFAOYSA-N
ID: 46874
SMILES:C(OCC(=O)OCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC2OC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -15.652
InChIKey:CCSUSTFJWZBARH-UHFFFAOYSA-N
ID: 46875
SMILES:CC1(CCC=C(C)C)Oc2c(O)cc(CCCCC)cc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 46876
SMILES:C(C)(C)C1CCC(C)C2C(c3c(cc(CCCCC)cc3O)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.857
InChIKey:PSLFDJICBDZIBL-UHFFFAOYSA-N
ID: 46877
SMILES:O(C)c1cc(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 46878
SMILES:C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -14.605
InChIKey:HKXVOIJVGVDECB-UHFFFAOYSA-N
ID: 46879
SMILES:C(C)(=CCc1cc(O)c2c(c1)OC(C)(C)C1CCC3(C)OC13C2)C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: Not available
InChIKey:RONZLEPHSYYBIG-UHFFFAOYSA-N
ID: 46880
SMILES:c1(C2C(C(=C)C)CC(C(=O)OC)C(C)=C2)ccc(C(C)(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.51
InChIKey:AHXFDCLEDJGWNL-UHFFFAOYSA-N
ID: 46881
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C(O)C=C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.123
InChIKey:VGKVCYNFQIGHHI-UHFFFAOYSA-N
ID: 46882
SMILES:c1c(CCCCCC)cc2c(c1O)C1(C(=O)OCC)C(C)(C=CC(C)OC2C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.648
InChIKey:CIKGYQPCQUJHJD-UHFFFAOYSA-N
ID: 46883
SMILES:C1(OC(C(O)CC)=O)C(C)C2C(c3c(O)cc(CCCCC)cc3OC2(C)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.358
InChIKey:ICDTUMANRAJFRA-UHFFFAOYSA-N
ID: 46884
SMILES:C1(=O)C2(C)C(=O)OC3(C(C1(C)C(O)=O)CCC1C3c3c(cc(CCCCC)cc3O)O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.508
CB1 binding score: -12.652
InChIKey:MLXKWLJMFVEWLD-UHFFFAOYSA-N
ID: 46885
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC1OC1(C)C)CCC(O)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.313
InChIKey:HMTIBTLOWAYWPC-UHFFFAOYSA-N
ID: 46886
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -16.744
InChIKey:XOPWMVXDFKLXGH-UHFFFAOYSA-N
ID: 46887
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(O)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -19.691
InChIKey:ZLYNXDIDWUWASO-UHFFFAOYSA-N
ID: 46888
SMILES:c12c(c(O)cc(CCCCC)c1)-c1c(ccc(C)c1O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.957
InChIKey:RKPJLXZTEWJEAM-UHFFFAOYSA-N
ID: 46889
SMILES:O(C(C(C)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)CC21)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -13.33
InChIKey:VYUHNVXDHIEQFY-UHFFFAOYSA-N
ID: 46890
SMILES:C12C(C)(CCC=C(C)C)CCCC1(C)Oc1c(c(O)c(C(=O)O)c(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -16.367
InChIKey:VMZBLXSYKJHOBU-UHFFFAOYSA-N
ID: 46891
SMILES:c1(O)c(O)c2c(cc1C(C)C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.638
InChIKey:KNZHIMYZHKNYSW-UHFFFAOYSA-N
ID: 46892
SMILES:C(C)(C1=Cc2c(c(CCC(OC(C)=O)C(C)=C)c3c(c2O)OC(C)(C)CC3)OC1(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -13.165
InChIKey:SRAJRRDHHRVMLR-UHFFFAOYSA-N
ID: 46893
SMILES:C1(C)=CC(c2c(O)c(C(O)=O)c(CCCCC)cc2O)C(O)C(C2=CC(=O)C(C)(C)O2)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.551
CB1 binding score: -16.924
InChIKey:CGPFQWQWFXXEHD-UHFFFAOYSA-N