ID: 127828
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 127829
SMILES:O1C(CCC=C(C)C)(C)CCc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.392
InChIKey:RCCCKQKOMSTGQP-UHFFFAOYSA-N
ID: 127830
SMILES:c1(CC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.316
InChIKey:HUIAWGFJOOMUSP-UHFFFAOYSA-N
ID: 127831
SMILES:C12=CC(C(C(=O)O)=C)CCC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.949
InChIKey:PSJAREIPBDEFQO-UHFFFAOYSA-N
ID: 127832
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -19.572
InChIKey:KKASRYPDNSSAPZ-UHFFFAOYSA-N
ID: 127833
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 127834
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 127835
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127836
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 127837
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)C(=O)C21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.122
InChIKey:FXXAPPNASPLHTH-UHFFFAOYSA-N
ID: 127838
SMILES:C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.796
InChIKey:BFFUWWHIAIGFJU-UHFFFAOYSA-N
ID: 127839
SMILES:c1c(CCC(=O)O)cc2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.708
InChIKey:BQCZWIRUKKJMBX-UHFFFAOYSA-N
ID: 127840
SMILES:C(=C)(C)C1C(c2c(O)cc(O)cc2CCCCC)CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.553
InChIKey:FQGMZWMPXDJYND-UHFFFAOYSA-N
ID: 127841
SMILES:c1c(O)cc(C)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 127842
SMILES:C1(C)CCC(C(CO)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.371
InChIKey:AWIDKDJWHBSCGE-UHFFFAOYSA-N
ID: 127843
SMILES:C1C(C)=CC(c2c(O)c(O)cc(CC=CC(=C)C)c2)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -14.732
InChIKey:BJRGDJAGSLWPQE-UHFFFAOYSA-N
ID: 127844
SMILES:CC(C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -16.26
InChIKey:YJINGGRIRCBRGU-UHFFFAOYSA-N
ID: 127845
SMILES:c1(C)c(Br)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -18.671
InChIKey:RPVWNWGEPFZWQS-UHFFFAOYSA-N
ID: 127846
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)CC=C1C)CC(C)(O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.519
InChIKey:ZOJIKSOQRVHGRJ-UHFFFAOYSA-N
ID: 127847
SMILES:C(C)CCCc1cc2c(cc1CCC)CC(O)C(C)(CCC1C(C)(C)O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -15.156
InChIKey:WBUYTCWFTDHKTR-UHFFFAOYSA-N
ID: 127848
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C(C=C)C(C=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.718
InChIKey:IXGNFLKEVYOYRB-UHFFFAOYSA-N