ID: 92821
SMILES:C1(C)(C)Oc2cc(C)c(Br)cc2C2C1CC(C=CC=C(C)C(O)=O)(C)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 449.341
CB1 binding score: -14.851
InChIKey:FAAMHIYINFGFBI-UHFFFAOYSA-N
ID: 92822
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 92823
SMILES:C(C)Cc1cc(O)c2c(c1)OC(CCC1C(C)(C)O1)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.033
InChIKey:XRVWSNFEQSGPTA-UHFFFAOYSA-N
ID: 92824
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC21)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.043
InChIKey:SPWIXAUTTOLBQR-UHFFFAOYSA-N
ID: 92825
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 92826
SMILES:OC1C(O)C(O)COC1Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -14.565
InChIKey:LJQMIKPQSKFUBJ-UHFFFAOYSA-N
ID: 92827
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 92828
SMILES:Oc1c(C(=O)C(C)CC)c(O)c2c(c1)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.438
InChIKey:VKVPFCMBOLWBNZ-UHFFFAOYSA-N
ID: 92829
SMILES:c12cc(CCCCC)cc(O)c1OC(C)(C(OC1CC(C)=CC(=O)O1)=O)C1C(O)C(O)(C)CCC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.577
CB1 binding score: -13.995
InChIKey:GJLZPMOXBJAGRZ-UHFFFAOYSA-N
ID: 92830
SMILES:C1C(C)=CCCC(C(=O)O)=CCC2C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.614
CB1 binding score: -17.427
InChIKey:NZJDMAPQAXDZBI-UHFFFAOYSA-N
ID: 92831
SMILES:c1(C)c2c(c3c(c1OC(C)=O)OC1(C)OCC(C)C1C3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -14.189
InChIKey:HTHVHXDSCYIRAV-UHFFFAOYSA-N
ID: 92832
SMILES:Oc1c(C)c(C=O)c(O)c2c1OC(C)(C)C1C2CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -13.181
InChIKey:VMBVVJQHTNMKAM-UHFFFAOYSA-N
ID: 92833
SMILES:O=C1C(C)=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.142
InChIKey:VZEZKAZGSUWZOT-UHFFFAOYSA-N
ID: 92834
SMILES:C(CCC1(C)Oc2c(c(O)cc(CO)c2)C2CCC(C)=CCC12C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: Not available
InChIKey:QMMAXHKHXPNIPV-UHFFFAOYSA-N
ID: 92835
SMILES:C1(C)(C)Oc2c(c(O)c(CCCCC)cc2)C2=C1CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.362
InChIKey:HBGAFPNNLBZETR-UHFFFAOYSA-N
ID: 92836
SMILES:CC12CC3C(C)(CC1CC(C)(C)C2)Oc1cc(CCCCC)c(C(=O)O)c(OCC=C(C)C)c13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -15.116
InChIKey:HPHBDCIJNIWUIL-UHFFFAOYSA-N
ID: 92837
SMILES:Oc1c2c(cc(C)c1)OC(C)(C)C=CCC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -17.77
InChIKey:WIHPWNOCRJICJO-UHFFFAOYSA-N
ID: 92838
SMILES:C(C)(C)C1C(c2c(O)cc(CCCCC)c(C(OC)=O)c2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -18.306
InChIKey:LQRAOZLHACSNNH-UHFFFAOYSA-N
ID: 92839
SMILES:O=C1OC2c3c(cc(CCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.305
CB1 binding score: -15.803
InChIKey:AFHCYNQYFMPHHB-UHFFFAOYSA-N
ID: 92840
SMILES:O=C(CN(C)C1=C(C)C(=O)OC(c2c(O)cc(CCCCCC)cc2)C1)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 375.465
CB1 binding score: -14.15
InChIKey:HFNLWAZGCWVFML-UHFFFAOYSA-N
ID: 92841
SMILES:C1CC(C(O)=O)=CC2c3c(cc(CCCCC[N+](C)(CC)C)cc3)OC12C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.567
CB1 binding score: -15.745
InChIKey:PSEFNPQCKWHZKX-UHFFFAOYSA-O