ID: 127849
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 127850
SMILES:c12c(c(O)cc(CCCCC)c1)C13C(C(C)(C)OC1CC(=O)O2)CCC3=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.661
InChIKey:UVECDBHLTPVADG-UHFFFAOYSA-N
ID: 127851
SMILES:Oc1c(C)cc(O)cc1C1C=C(C)CCC(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.974
InChIKey:RPIJETGTEDGMCO-UHFFFAOYSA-N
ID: 127852
SMILES:O=C(O)C12CCC(C)=CC1c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.929
InChIKey:VYSBBFRCEWLFAX-UHFFFAOYSA-N
ID: 127853
SMILES:C1Oc2c(cc(C)c(C3C(C(C)=C)CCC(C)=C3)c2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.974
InChIKey:XZSOQPULPTWOJT-UHFFFAOYSA-N
ID: 127854
SMILES:C1CC(C)=CC2c3c(O)cc(CCCCC)cc3OC1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.021
InChIKey:QKAUWBYMMLMIGS-UHFFFAOYSA-N
ID: 127855
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127856
SMILES:CC(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 127857
SMILES:C12C(C)(OCc3c(cccc3C)C1)Oc1ccc(CCCCCC)cc1C2=CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.632
CB1 binding score: -15.929
InChIKey:ZHDVZHVWNWFYEN-UHFFFAOYSA-N
ID: 127858
SMILES:c12cc(OC)c(C)cc1OC(CC(C)CCCC(=O)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.728
InChIKey:PASXNYJPTWENDD-UHFFFAOYSA-N
ID: 127859
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 127860
SMILES:C1=C(C)CCC(C(C)(C)O)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 127861
SMILES:C1C(C2=Cc3c(c(C)c(C#N)c(C)c3O)N2)CC(C)=CC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.629
CB1 binding score: -13.305
InChIKey:HOJMRCBQUJXSNX-UHFFFAOYSA-N
ID: 127862
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 127863
SMILES:C(=C(CCC1C(C)(C)CCCC1C)C)C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.685
CB1 binding score: -16.986
InChIKey:ASPXIXUDLIVDRL-UHFFFAOYSA-N
ID: 127864
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC=C(C)CCC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: -16.998
InChIKey:KFVYKJPZCPVXSW-UHFFFAOYSA-N
ID: 127865
SMILES:CC(C)C1C(c2c(O)cc(CCCCC)cc2O)CC(C)(O)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.949
InChIKey:CKTMLOKCMWIEAG-UHFFFAOYSA-N
ID: 127866
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)=O)CCC(C)(O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -20.47
InChIKey:VMODRHMUQLFVST-UHFFFAOYSA-N
ID: 127867
SMILES:C1C2(C)C3C(c4c(O)cc(C)cc4OC3OCC(C)=CCCC(C)=C1)CC(=O)C2CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -13.008
InChIKey:GENCJADMNQRLIL-UHFFFAOYSA-N
ID: 127868
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)=CC(=O)C1C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.827
InChIKey:FZFXHQKPZAUMDJ-UHFFFAOYSA-N
ID: 127869
SMILES:Oc1c(CC=C(CCC=C(C)C)C=O)c(O)cc(CC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.096
InChIKey:TYHHCIABUYSEFL-UHFFFAOYSA-N