ID: 60754
SMILES:CC(=CCCC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C(OC(=O)C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -15.929
InChIKey:PQKAPFBWJJEVFI-UHFFFAOYSA-N
ID: 60755
SMILES:c1c(C2CC(=O)c3c(O)cc(CCCCC)cc3O2)cc2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Shikimates and Phenylpropanoids
Superclass: Meroterpenoids;Flavonoids
Class: Cannabinoids;Flavanones
MW: 462.63
CB1 binding score: -15.523
InChIKey:KZKBNFCKZOIDPE-UHFFFAOYSA-N
ID: 60756
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 60757
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 60758
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 60759
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CC2)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: Not available
InChIKey:RXQNVJSABCYOJX-UHFFFAOYSA-N
ID: 60760
SMILES:C1C(C)(C)Oc2c(C(C(CC)C)=O)c(O)c(C3C(C(CCC=C(C)C)C)C(O)CC(C)=C3)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -12.894
InChIKey:VPEIITZQSOUYEZ-UHFFFAOYSA-N
ID: 60761
SMILES:C1(C)=CCc2c(C=Cc3c(O)c(CC=C(CCC=C(C)C)C)c(O)cc3CCCCC)C=C(C)CCC2C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.848
CB1 binding score: -15.383
InChIKey:JHJWIAREHUQDKK-UHFFFAOYSA-N
ID: 60762
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC=C(C)C1)CC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.929
InChIKey:NAUCYZHUNXGLGG-UHFFFAOYSA-N
ID: 60763
SMILES:c1(O)cc(CCCC(O)=O)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.344
InChIKey:LHOTXBHEVDXIOE-UHFFFAOYSA-N
ID: 60764
SMILES:C(C(C)=CC(=O)C=C(C)C)(O)c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.113
InChIKey:WIQVLMGAEMGNGZ-UHFFFAOYSA-N
ID: 60765
SMILES:C=C1CCC2C(C)(C)C2C1c1c(O)cc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.609
InChIKey:JHTNRUSKZABJOY-UHFFFAOYSA-N
ID: 60766
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 60767
SMILES:CC1(C)C(Br)CCC2(C)CC(O)(c3c(O)cc(CCCCC)cc3O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.407
CB1 binding score: -15.01
InChIKey:NQHLVSFBBOQEPQ-UHFFFAOYSA-N
ID: 60768
SMILES:c1(CCc2ccc(O)cc2)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -18.334
InChIKey:QLPVCOQUNQFEAZ-UHFFFAOYSA-N
ID: 60769
SMILES:C12C(C)(Oc3c(c(O)cc(CCC)c3)C1O)CCC(C(C)=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.434
InChIKey:LMYFERRALZGUSM-UHFFFAOYSA-N
ID: 60770
SMILES:C(=O)(C)OC1C(C)(C)C2CCC3C(Cc4c3cc(CCCCC)cc4O)C21C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.021
InChIKey:RNYIRHPZNLBMHK-UHFFFAOYSA-N
ID: 60771
SMILES:O1c2cc(CCCCC)cc3c2C(=O)OC(C)(C)C3CC1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.285
InChIKey:HHXQXBNTHGDKJG-UHFFFAOYSA-N
ID: 60772
SMILES:CCCCc1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.779
InChIKey:VXMYRUJLTHSFQU-UHFFFAOYSA-N
ID: 60773
SMILES:CC(C)(OC(=O)c1c(C)c2c(cc1C)OC(C)(C)CC2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -13.103
InChIKey:RGHXIZULIXFFSG-UHFFFAOYSA-N
ID: 60774
SMILES:C1(CC=C(C)C)CC(C(C)=C)C(c2c(O)cc(CCOC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.388
InChIKey:PRXOCUBDJQDQOA-UHFFFAOYSA-N