ID: 111406
SMILES:C12C(CC(C)=CC1(Oc1cc(CCCCC)cc(O)c1)C)C=C(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -13.312
InChIKey:XBAPWEQBHRVJSA-UHFFFAOYSA-N
ID: 111407
SMILES:c1(O)c(OC)cc2c(c1O)CCC1(C)Oc3c(cc(OC)c(CCCCC)c3)C(C=C(C)C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -15.62
InChIKey:LTHDIGCSNTYWKQ-UHFFFAOYSA-N
ID: 111408
SMILES:C(CC(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.743
InChIKey:PKLUWGUUSHBNIQ-UHFFFAOYSA-N
ID: 111409
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1C(=C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.532
InChIKey:QTGWJFBHIBZPJK-UHFFFAOYSA-N
ID: 111410
SMILES:CC1(C)C2CC=C(C)CC2c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.418
InChIKey:UEUDZYHJJLDGIZ-UHFFFAOYSA-N
ID: 111411
SMILES:C12C(O)C(C)=CCC1C(C)(C)Oc1ccc(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.057
InChIKey:OGOAPLJUFMNRCL-UHFFFAOYSA-N
ID: 111412
SMILES:C(c1cc(C23C(C(C)(C)CC(O)C2)Oc2cc(CCCCC)cc(O)c2C3)ccc1O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -13.518
InChIKey:BLXZXTFJQMFIJY-UHFFFAOYSA-N
ID: 111413
SMILES:O=C(c1c(O)c(C2C(C(C)C)CCC(C)=C2)c(CC=C(C)C)c(O)c1)OCC(C)=CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -12.769
InChIKey:YIVJJFWILJDBEJ-UHFFFAOYSA-N
ID: 111414
SMILES:C(CCCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)C1)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.608
InChIKey:FWCXIBWUPQYQDZ-UHFFFAOYSA-N
ID: 111415
SMILES:Oc1cc(CCCCC)cc(OC)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 111416
SMILES:C(C)(=CCCC(O)(C)C1C(c2c(O)cc(CCC)cc2O)C=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.666
InChIKey:LKKCHDKJKUFVJK-UHFFFAOYSA-N
ID: 111417
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 111418
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC(OC(=O)C)C3(C1=O)CC(C(=O)C=C(C)C)CC3(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: -16.504
InChIKey:XQBIAHSFGZRRMS-UHFFFAOYSA-N
ID: 111419
SMILES:COc1c(OC)c(C)cc2c1C1C=C(C)C(O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.333
InChIKey:PNYGNTJDXMGFDR-UHFFFAOYSA-N
ID: 111420
SMILES:C1C(C)CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.816
InChIKey:SQJMDIOOAXOERN-UHFFFAOYSA-N
ID: 111421
SMILES:c1(OC)c2c(cc(CCCCC)c1)OC(C)(C)C1CC(=O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -19.072
InChIKey:WHZWAUGXNKSVSQ-UHFFFAOYSA-N
ID: 111422
SMILES:CC1(C)CC(OC2=CC(OC)=C(C(C)=O)CC2=O)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -14.457
InChIKey:KAXRSUACXOWRGP-UHFFFAOYSA-N
ID: 111423
SMILES:c1(O)cc(C)cc(O)c1C1C=C(C)CCC1C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.893
InChIKey:BHBGTEBQXNKBCT-UHFFFAOYSA-N
ID: 111424
SMILES:OCC(=CCCC(C)=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -18.748
InChIKey:UHRCXKCSCBRZGD-UHFFFAOYSA-N
ID: 111425
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(C(Cc2ccccc2)=O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.707
CB1 binding score: -16.502
InChIKey:NOQRUHDXSYFXMF-UHFFFAOYSA-N
ID: 111426
SMILES:C(CC=C(C)CO)C1(C)CCC(C)=CC1c1c(O)cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -11.672
InChIKey:PACUSOBUNYWHQX-UHFFFAOYSA-N