ID: 20959
SMILES:C1(C)C2C(O)CC(=C)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -11.695
InChIKey:WEBDEKLAEJUODV-UHFFFAOYSA-N
ID: 20960
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 20961
SMILES:c1(O)cc(CCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 20962
SMILES:CC(CCCCC)=CCc1cc(OC)c2c(c1)OCC(c1c(OC)ccc(CCCCC)c1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -11.745
InChIKey:VETLXSCMKJKTGN-UHFFFAOYSA-N
ID: 20963
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 20964
SMILES:C1C(C)(O)Cc2c(O)cc(CCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 206.285
CB1 binding score: -13.098
InChIKey:UYMJMBPEYZYVNN-UHFFFAOYSA-N
ID: 20965
SMILES:C1C(O)C(C)=C(c2c(O)cc(CCCCC)cc2O)CC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.521
InChIKey:AHCOGFDAUAGBAF-UHFFFAOYSA-N
ID: 20966
SMILES:C1(=C)CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.067
InChIKey:HRWSDIFPFHPUTH-UHFFFAOYSA-N
ID: 20967
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 20968
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 20969
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 20970
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3c(c(OC)cc(CCCCC)c3O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -12.856
InChIKey:CCWPFYKSOMLHOR-UHFFFAOYSA-N
ID: 20971
SMILES:C(C1CC2C(C)CCC22C(C)(CC1)Oc1cc(C)cc(O)c12)(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.507
InChIKey:RJKAWTCZVUIZQR-UHFFFAOYSA-N
ID: 20972
SMILES:CC1=CC(c2ccc(CCCCC)c(O)c2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.81
InChIKey:QGYAYVXCIOXLNW-UHFFFAOYSA-N
ID: 20973
SMILES:CC(C1CCC(C(=C)C)=C(c2c(O)cc(CCCCC)cc2O)C1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.951
InChIKey:FFADFSNBWCEKJD-UHFFFAOYSA-N
ID: 20974
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C(O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.936
InChIKey:VOXDBJOUHMBAOR-UHFFFAOYSA-N
ID: 20975
SMILES:CC(C)=CCCC(=CCc1c(O)ccc(CCCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 314.513
CB1 binding score: -17.43
InChIKey:DOKRBMNNIIGHQA-UHFFFAOYSA-N
ID: 20976
SMILES:C(C=Cc1cc2c(c(O)c1)C1C(O)C(C)(O)CCC1C(C)(C)O2)C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.078
InChIKey:PEGLPGBQEXACEY-UHFFFAOYSA-N
ID: 20977
SMILES:C1=C(C)CCC2OC2(C)CCC2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -18.982
InChIKey:CKPQLRBRCDKZHC-UHFFFAOYSA-N
ID: 20978
SMILES:c1(CCCCC)cc2c(cc1O)OC1CC(C)(CC(O)C1C(C)=C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.289
InChIKey:YQEPMKMZZKPKLE-UHFFFAOYSA-N
ID: 20979
SMILES:C1=C(CO)CCC=C(C)CCC2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.756
InChIKey:KZSPITWSGNVMLP-UHFFFAOYSA-N