ID: 44773
SMILES:C1CC(C(C)C)(O)C(c2c(O)cc(CCCCCO)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.055
InChIKey:PNKZTXBYFUNSOM-UHFFFAOYSA-N
ID: 44774
SMILES:C(CCC)Cc1cc(O)c2c(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: 44775
SMILES:C(C)(C)Cc1c(O)c(CC=C(C)C)c(-c2c(O)c(O)cc(CCCCC)c2)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.792
CB1 binding score: -15.005
InChIKey:WVUMFKQSDVKTQM-UHFFFAOYSA-N
ID: 44776
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2CC1CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.479
InChIKey:KBVHLVSZSHTOQU-UHFFFAOYSA-N
ID: 44777
SMILES:CC(CC(=O)c1c(O)c(C=O)c2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 386.488
CB1 binding score: -12.391
InChIKey:MWBMNPDRYPWMKX-UHFFFAOYSA-N
ID: 44778
SMILES:c1(C2(CC)OC(C)(C)CC2)c(O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.591
InChIKey:JQOGOLVPMZPQMH-UHFFFAOYSA-N
ID: 44779
SMILES:COC(c1ccc(C=C2C(C)CCC(C(C)(O)C)C2c2c(OC(=O)C)cc(CCCCC)cc2O)cc1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.682
CB1 binding score: -15.929
InChIKey:URKFKOODUDUPQT-UHFFFAOYSA-N
ID: 44780
SMILES:CC(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 44781
SMILES:c12c(c(O)c(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.349
InChIKey:PVWKYDHSQZSCHQ-UHFFFAOYSA-N
ID: 44782
SMILES:O1C(C)(C)C2C(C)(CC1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.156
InChIKey:MTZAJMZJURUDTO-UHFFFAOYSA-N
ID: 44783
SMILES:CC1CC(c2c(O)cc(CCCCC)cc2O)C(C(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -17.898
InChIKey:UTLOHIYXFFDSOJ-UHFFFAOYSA-N
ID: 44784
SMILES:C(C=CCCCCC)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.608
InChIKey:FPRZEEWGPPQLOJ-UHFFFAOYSA-N
ID: 44785
SMILES:CCCCCc1cc(O)c2c3c1C1C(C(C)(C)O3)CC3OC1(C)C2C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -12.362
InChIKey:QKRHFWPMVMFBQP-UHFFFAOYSA-N
ID: 44786
SMILES:c1(C)c(OC)c2c3c(c1)OC(C)(C)C1CCC(=C)C3C1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -12.299
InChIKey:ZJQICRGDQFCROA-UHFFFAOYSA-N
ID: 44787
SMILES:c1c(O)c(C)c2c(c1)C1C(c3c(cc(CCCCC)cc3O)OC1(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -14.622
InChIKey:CTGHEEVZFBQMJX-UHFFFAOYSA-N
ID: 44788
SMILES:C12c3c(c(OC)cc(CCCC)c3)C(C=C(C)C)OC(C)(C=C1)C(CO)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.246
InChIKey:KHOMHRQRVYYNQQ-UHFFFAOYSA-N
ID: 44789
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C1C=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.987
InChIKey:BCHRTEOIPGOFDL-UHFFFAOYSA-N
ID: 44790
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.334
InChIKey:VEBHZTTZGZYZIW-UHFFFAOYSA-N
ID: 44791
SMILES:c1(CO)ccc2c(c1Cc1cc(CCCCC)ccc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -16.09
InChIKey:CARCKDPDPRZSGR-UHFFFAOYSA-N
ID: 44792
SMILES:C1CC(C(C)(C)O)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -18.012
InChIKey:BWTXRXWJBUBROE-UHFFFAOYSA-N
ID: 44793
SMILES:C(=CC)Cc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.968
InChIKey:ITQNAHSPBAWPAM-UHFFFAOYSA-N