ID: 95740
SMILES:c1(O)cc(CCCCC)cc2c1C1C(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: 95741
SMILES:C(C)(=CC)C(Oc1cc(CCCCC)cc(O)c1C1CC(C)(O)C(=O)CC1C(C)=C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.798
InChIKey:GMLZJBAPOZCAFB-UHFFFAOYSA-N
ID: 95742
SMILES:C1(c2c(O)cc(CCCCC)c(C=O)c2O)(C)CCCC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.521
InChIKey:MKHRGAFLQAPDBX-UHFFFAOYSA-N
ID: 95743
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C(C)(O)CCC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.965
InChIKey:XXRIJTPTULWYSR-UHFFFAOYSA-N
ID: 95744
SMILES:C(C(CC)C)(c1cc(C)c2c(c1)C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -15.772
InChIKey:WDFVZETYNOURJH-UHFFFAOYSA-N
ID: 95745
SMILES:COc1cc(C)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -16.719
InChIKey:NSFUTTBAEVJOGX-UHFFFAOYSA-N
ID: 95746
SMILES:CC1(C)C2CCC(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 95747
SMILES:C(CC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)C=C(C(O)CC=C(C)C)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.092
InChIKey:HTIDKINRISNJLM-UHFFFAOYSA-N
ID: 95748
SMILES:C1(C2C=C(C)CCC2C(C)=C)=C(O)C(NCC(C)C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -14.793
InChIKey:SUAFEVLXZDVTPS-UHFFFAOYSA-N
ID: 95749
SMILES:C(CCCCCC(=O)Oc1cc(CCCC)cc2c1C1(O)C(CC(C)=CCC2)OC1=O)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -15.848
InChIKey:LUMBSTYFNOEJGO-UHFFFAOYSA-N
ID: 95750
SMILES:C1CC2C(C)(Oc3cc(CCCCCNC)cc(O)c31)CCC2(OC1C(O)C(O)C(O)CO1)C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 523.667
CB1 binding score: -14.744
InChIKey:LHAOIVITQWWCGN-UHFFFAOYSA-N
ID: 95751
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1(O)OC(C)(CCC=C(C)C)C(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.058
InChIKey:ZSQFDOHSLPHRKD-UHFFFAOYSA-N
ID: 95752
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.627
InChIKey:WKVIRZJNKJVJOP-UHFFFAOYSA-N
ID: 95753
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 95754
SMILES:C1(C)(C)Oc2c(cc(CCCCC)cc2O)C2C=C(C(=O)O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.706
InChIKey:LCQRHLUIMXHDPP-UHFFFAOYSA-N
ID: 95755
SMILES:c1(CCCC(O)C)c(C=O)c(O)c2c(c1)OC1(C)C3C2C(CC1)C3CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.901
InChIKey:BPTRFBAPLMPXFL-UHFFFAOYSA-N
ID: 95756
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c(c(O)cc(C)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.845
InChIKey:GRMCVSGABMYXIQ-UHFFFAOYSA-N
ID: 95757
SMILES:C1C(O)C2C(C)(C)Oc3c(c(OC)cc(CC=C)c3)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.533
InChIKey:KELBYKJXOXOPIH-UHFFFAOYSA-N
ID: 95758
SMILES:C1(C)=CC2C(c3c(O)cc(CCC)cc3OC2(C)C)C(O)C=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.872
InChIKey:DRUCBFMQUCEWRB-UHFFFAOYSA-N
ID: 95759
SMILES:O=Pc1c2c(c(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.434
CB1 binding score: -14.765
InChIKey:DZDXNZGUNYAPTQ-UHFFFAOYSA-N
ID: 95760
SMILES:C(=CCCC(C)=CCc1c(O)cc(CCC)c(C=O)c1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 316.441
CB1 binding score: -19.683
InChIKey:PLVFSLOPGLUASL-UHFFFAOYSA-N