ID: 44815
SMILES:c1(CCCCCC)c2c(oc1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -14.78
InChIKey:XLUBJPIRBHCFBD-UHFFFAOYSA-N
ID: 44816
SMILES:OC12C(CCC(C)=C1)C(C)(C)Oc1cc(CCCCC)c(C(=O)OC)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.499
InChIKey:YRIKAZMMLFSIPZ-UHFFFAOYSA-N
ID: 44817
SMILES:C1C2(C)C(c3c(O)cc(CCCCC)cc3O1)CC(C(C)C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.297
InChIKey:CQRATSUFNFLHPE-UHFFFAOYSA-N
ID: 44818
SMILES:c1(O)c2c(cc(C)c1)-c1c(cc(CCCCC)cc1O)OC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.812
InChIKey:VHDGUCWQBVUWAD-UHFFFAOYSA-N
ID: 44819
SMILES:C(CCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.892
InChIKey:MUCXZHMSXRTLLF-UHFFFAOYSA-N
ID: 44820
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(OC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.879
InChIKey:QUTSEXVWDYCFLT-UHFFFAOYSA-N
ID: 44821
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C(C(OC)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 44822
SMILES:CCCCCc1ccc2c(c1)C1(OC)C(C=Cc3c2cc(O)c2c3cc(O)c(C3C=C(C)CCC3C(=C)C)c2O1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.695
CB1 binding score: -15.452
InChIKey:MRLCVZDMLCONKV-UHFFFAOYSA-N
ID: 44823
SMILES:C(C)CCCc1cc(O)cc2c1OC13C(C(CCC=C(CO)C)=CC1=CC(=O)CC2)C(C=C(C)C)OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.737
CB1 binding score: -11.804
InChIKey:NENPRYBXKGRCCB-UHFFFAOYSA-N
ID: 44824
SMILES:CC1=CCCC(C)=CC2C(CC1O)C(C)(C)Oc1c2cccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.54
InChIKey:BHMPYSMGSHQYPP-UHFFFAOYSA-N
ID: 44825
SMILES:CC1=CC(c2ccc(CCCCC)c(OC)c2OC)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.174
InChIKey:JVWPHBUKNCHFTJ-UHFFFAOYSA-N
ID: 44826
SMILES:C1C(C)=C2CCC(C)=CC2c2c1cc(CCCCC)cc2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -16.41
InChIKey:ODJCCIOVPUAPFT-UHFFFAOYSA-N
ID: 44827
SMILES:C12CC=C(C)CC1c1c(O)cc(CCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.432
InChIKey:IGFPDZOXIOPCCQ-UHFFFAOYSA-N
ID: 44828
SMILES:C1(CO)=CC2c3c(cc(CCCCC)c(C(=O)OC(C)=O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -15.665
InChIKey:RAJKFDCUJXESIX-UHFFFAOYSA-N
ID: 44829
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 44830
SMILES:C1C(=C)CCC(C(C)C)C1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.317
InChIKey:SGMZMRJUIFYMOB-UHFFFAOYSA-N
ID: 44831
SMILES:C1C=C(C)CC2c3c(C)c(O)cc(c3CO)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.877
InChIKey:OADIZVNHKMAWJO-UHFFFAOYSA-N
ID: 44832
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.997
InChIKey:SFQKGBNHUNHRAM-UHFFFAOYSA-N
ID: 44833
SMILES:CC(OC)c1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1CC(=O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -15.398
InChIKey:IRDILEYEMOYJLF-UHFFFAOYSA-N
ID: 44834
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1C=C(C(O)=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 44835
SMILES:C1C2(C3CCC(O)CC3OC2CO)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.286
InChIKey:JQTQAOJNAQRPGF-UHFFFAOYSA-N