ID: 121591
SMILES:C(c1c2c(ccc1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -17.785
InChIKey:RMBZLTVVOIVDDK-UHFFFAOYSA-N
ID: 121592
SMILES:CC1=CCc2c(c(OC)cc(CCCCCCCC)c2)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.578
CB1 binding score: -13.633
InChIKey:JKSWNWHCUBLMDV-UHFFFAOYSA-N
ID: 121593
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)cc(CCC(=O)C)c(CC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.429
InChIKey:GJLOJRTWUNNXPB-UHFFFAOYSA-N
ID: 121594
SMILES:C(c1c(O)c(C=O)c(O)c(C2C=C(C)CCC2C(=C)C)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.016
InChIKey:LMWYIXVJAUHYJC-UHFFFAOYSA-N
ID: 121595
SMILES:C(O)C=Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -18.751
InChIKey:SVQBWLSSLVMNBD-UHFFFAOYSA-N
ID: 121596
SMILES:C(CC)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 121597
SMILES:CC12C(=O)CC(C(C)=C)C1c1c(O)ccc(CCCCC)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.423
InChIKey:ZGAYQVHIZJICGG-UHFFFAOYSA-N
ID: 121598
SMILES:COc1cc(CCCCC)cc2c1C1C(C(=C)C)(C(=O)C2)C(C)C2CCC(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -14.533
InChIKey:HDBNEVRHBNFXFH-UHFFFAOYSA-N
ID: 121599
SMILES:C1C(CC=C(C)C)C(=O)c2ccc(CCCC(C)CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.79
InChIKey:TZFYOYINZYPKCO-UHFFFAOYSA-N
ID: 121600
SMILES:C1(=O)C(C)=CC(c2c(O)cc(CCC)cc2O)C=C(C)CCC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.343
InChIKey:UDUQNMQXXUZKGJ-UHFFFAOYSA-N
ID: 121601
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 121602
SMILES:C1(CC(C)C=C2C(=O)C(C)CCC2C(C)=C)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -14.912
InChIKey:UIAKFUAAFJLLSN-UHFFFAOYSA-N
ID: 121603
SMILES:C1C2(C)Oc3c(CCCCC)cc(O)cc3C23C(=C(C(OC)=O)C(OC)=O)C1C(C)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -18.119
InChIKey:FJLZVXDDOAMXJK-UHFFFAOYSA-N
ID: 121604
SMILES:C(=C(CCc1c(O)cc(CCCCC)cc1O)C)C=CC(C)(O)C
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 332.484
CB1 binding score: -16.565
InChIKey:JWQNLTYLPFEXIZ-UHFFFAOYSA-N
ID: 121605
SMILES:C12C(C=C(C)CC1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 121606
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2(C)CCCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.033
InChIKey:SZSYMEHFAYCXBE-UHFFFAOYSA-N
ID: 121607
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(CCC=C(C)C)C(=O)CC1(C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.103
InChIKey:QAMBPOCWZOJDSW-UHFFFAOYSA-N
ID: 121608
SMILES:Oc1c(OC2C(O)C(O)C(O)C(CO)O2)cc(CCCCCC)c2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.636
CB1 binding score: -12.407
InChIKey:IDHVQFBKAYBGQF-UHFFFAOYSA-N
ID: 121609
SMILES:CC1(C)CCC(=O)C2(C)OC12Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.749
InChIKey:OAXGHIMLZVYVIV-UHFFFAOYSA-N
ID: 121610
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(C)c(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 314.513
CB1 binding score: -16.57
InChIKey:UGEXNGMDXBIBGB-UHFFFAOYSA-N
ID: 121611
SMILES:C12C(C)(Oc3cc(CCCCC)cc(O)c31)CCC1C(C)(C)C(O)CCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -17.5
InChIKey:ZXJPFXZHBXRYLJ-UHFFFAOYSA-N