ID: 29716
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C(=C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.846
InChIKey:NBVPTAKVRPHONU-UHFFFAOYSA-N
ID: 29717
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -19.67
InChIKey:QXOBJECFIJLBPW-UHFFFAOYSA-N
ID: 29718
SMILES:C(Cc1c(O)c2c(cc1C)OC(C)(C)C1C2C=C(C(=O)O)CC1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.823
InChIKey:XNTYCOVNAHUAHX-UHFFFAOYSA-N
ID: 29719
SMILES:c12c3c(cc(C)c1)OC(O)(CN=C(C)C)C3CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 289.375
CB1 binding score: -15.789
InChIKey:GSJBOLHYLOQTJT-UHFFFAOYSA-N
ID: 29720
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: 29721
SMILES:c12cc(CCCCC)cc(O)c1C1CC(C(O)(C)C)C3C4(C(CCC3(C)O1)O2)C(=O)CC4C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -13.358
InChIKey:YJKZPTVWDJUZRA-UHFFFAOYSA-N
ID: 29722
SMILES:C(=C)(C)C1C=CC2(C)Oc3c(c(OC(C)=O)c(OC(=O)C)c(CCCCC)c3)CC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -11.934
InChIKey:LVECCWWZJVHRKP-UHFFFAOYSA-N
ID: 29723
SMILES:COc1c(C2C=C(C)CCC2C(=C)C)c(OC)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.928
InChIKey:SWCYTGJBQQPCEM-UHFFFAOYSA-N
ID: 29724
SMILES:CC1(C)C2CCC(C)=CC2c2c(cc(CCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 29725
SMILES:Oc1cc(CCCCC)c(C2C(O)C(O)CC(CO)O2)c(O)c1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -13.881
InChIKey:NHMLTWNBGBKGHI-UHFFFAOYSA-N
ID: 29726
SMILES:C1C(CCc2cc(OC)cc(C)c2OC)=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.131
InChIKey:BQCDMSFKBCLZAG-UHFFFAOYSA-N
ID: 29727
SMILES:C1(CCC=C(C)C)(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: 29728
SMILES:C(CCCCCCC)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.772
InChIKey:AVHJVMOMLXSEPR-UHFFFAOYSA-N
ID: 29729
SMILES:C1C(c2c(O)cc(CCCC(C)C)cc2O)(C)C(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -15.718
InChIKey:GSGPRYIVINZOQY-UHFFFAOYSA-N
ID: 29730
SMILES:C(C)CCCCc1cc(O)c(CC2C3(C)CCC(CCC3(C)OC2(CCCC(C)C(O)=O)C)=O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.719
CB1 binding score: -16.644
InChIKey:IQWPIZNXHAYCPE-UHFFFAOYSA-N
ID: 29731
SMILES:CC(C)C12C(c3c(cc(CCCC)c(C(=O)O)c3O)O1)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.983
InChIKey:NODGXPFSHBKIOC-UHFFFAOYSA-N
ID: 29732
SMILES:C1(C)(C)Oc2c(ccc(CCC)c2)CC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -15.652
InChIKey:KAKIAXXVVAMSKA-UHFFFAOYSA-N
ID: 29733
SMILES:c1(CCC)cc(C2C=C(C)CCC2C(C)=C)c(O)c(C=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.929
InChIKey:QZYMIDDULUYOCP-UHFFFAOYSA-N
ID: 29734
SMILES:C1(C)CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 29735
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3C(C)(O3)CCC(O)C1(C)OCC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.392
InChIKey:CWLUMEFAZNRLTE-UHFFFAOYSA-N
ID: 29736
SMILES:CC1=CC(c2c(CCCCC)cc(O)cc2)C(C(CCCC(C)C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.621
CB1 binding score: -12.831
InChIKey:FFBQKTNGUUYEMU-UHFFFAOYSA-N