ID: 95845
SMILES:C1C(C(C)C)C(c2cc(CCCC)ccc2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 270.46
CB1 binding score: -17.306
InChIKey:QFFJMHQQSHTSJU-UHFFFAOYSA-N
ID: 95846
SMILES:C1(O)c2c(c(=O)cc(C(O)=O)c(CCCCC)c2)C2C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.85
InChIKey:DTHLQBBKZDPDQO-UHFFFAOYSA-N
ID: 95847
SMILES:CCCCCc1cc2c(c(O)c1)C1C(O1)C(O)(C)C(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -14.838
InChIKey:PFIYHXKRQQMYBS-UHFFFAOYSA-N
ID: 95848
SMILES:C(CC(C(C)(O)COC(C)=O)O)C(CCOc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.637
CB1 binding score: -13.716
InChIKey:YGDHHGBHIWEHET-UHFFFAOYSA-N
ID: 95849
SMILES:C1C(O)C(C)=CCC2C(C)(C)Oc3cc(CCCCC)c(O)c(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.341
InChIKey:WCJICFRGEZONOT-UHFFFAOYSA-N
ID: 95850
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC1(C)CC(O)C(C(C)=C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.061
InChIKey:HUOXSLPUARPRCP-UHFFFAOYSA-N
ID: 95851
SMILES:C1C2(C)C3(c4c(cc(CCC)cc4O)O2)CCC1(C)OC3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.929
InChIKey:AEAAXULKQKDHBC-UHFFFAOYSA-N
ID: 95852
SMILES:CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 95853
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 95854
SMILES:C(CC(=CCCC1(C)Oc2c(Cc3c(O)c(CC=C(C)C)c(O)cc3C)c(C)cc(O)c2)CC1C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.792
CB1 binding score: -13.756
InChIKey:JYVLVMHBMIDILO-UHFFFAOYSA-N
ID: 95855
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)(CCCCCCCCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.685
CB1 binding score: -15.12
InChIKey:LXOWURMZYMPHJY-UHFFFAOYSA-N
ID: 95856
SMILES:c1(CCCCC)cc2c3c(c1O)OC1(C)CC3C(CC(C(C)=C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.475
InChIKey:GOBOAIQMDUHLKE-UHFFFAOYSA-N
ID: 95857
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 95858
SMILES:CC(c1c2c(c3c(c1O)C=CC(C)(C)O3)CC(C)(C)OC2CC(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.981
InChIKey:GHFQLPFXNWGXTK-UHFFFAOYSA-N
ID: 95859
SMILES:c1(C=CC(CCCC(C)C)(C)O)c(CCCCCC)cc2c3c1OC1(C)CCC(C2C1)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -16.174
InChIKey:MQPWITRMWJFTFQ-UHFFFAOYSA-N
ID: 95860
SMILES:Oc1c2c(ccc1C)OC(C)(C)C1C2CC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.981
InChIKey:KCJQFSVDSIOFNM-UHFFFAOYSA-N
ID: 95861
SMILES:OCC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCC)c3)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -17.858
InChIKey:RYAKSGPZEJLWBM-UHFFFAOYSA-N
ID: 95862
SMILES:c1cc(CCC(C)C(CC)(C)C2=C3C(C=O)(C4C(C)(C)C4C3)C(=C)C=C2)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.595
CB1 binding score: -16.022
InChIKey:FSBKBUUVJDSDKC-UHFFFAOYSA-N
ID: 95863
SMILES:C(CCC)c1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.935
InChIKey:WQWOLTTULXLSHU-UHFFFAOYSA-N
ID: 95864
SMILES:C1CC(C(C)C)CC2C(c3c(O)cc(CCCCC)cc3O2)C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.839
InChIKey:JPSMBZHXUFDEIV-UHFFFAOYSA-N
ID: 95865
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N