ID: 11866
SMILES:O1C(=O)C(C)C2C1C1C(c3c(O)cc(CCCCC)cc3O1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.409
InChIKey:RWOZTAZSIBZSIT-UHFFFAOYSA-N
ID: 11867
SMILES:CC1(C)Oc2c(cc3c(c2OCC)C=CC(C)(CCC=C(C)C)O3)CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.643
InChIKey:BUUKFZGHQBLARQ-UHFFFAOYSA-N
ID: 11868
SMILES:O(C(=O)C(=CC)C)C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(C)c3)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -12.075
InChIKey:IEOIEPFGZNRTDZ-UHFFFAOYSA-N
ID: 11869
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(=O)CCC(C)C)(C)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.137
InChIKey:CTOFEZMERFDTIW-UHFFFAOYSA-N
ID: 11870
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.225
InChIKey:BEXSRXTVRHPHGL-UHFFFAOYSA-N
ID: 11871
SMILES:c1(O)c(C(C(C)C)=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 11872
SMILES:CC1(C)Cc2c(c(O)c(C)cc2O)-c2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.952
InChIKey:GOGPHSAWCWOUNS-UHFFFAOYSA-N
ID: 11873
SMILES:CC12CC3c4c(O)cc(CCCCC)cc4OC3(C)CCC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.831
InChIKey:AETIDYRFIBWQMI-UHFFFAOYSA-N
ID: 11874
SMILES:c1c(CCCCCC)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 11875
SMILES:c1(C(=O)C(CC)C)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.192
InChIKey:PZUFUOGEVRTPTJ-UHFFFAOYSA-N
ID: 11876
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 11877
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 11878
SMILES:O=C1CC(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.16
InChIKey:AOVKDIWNRFBOBZ-UHFFFAOYSA-N
ID: 11879
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1=C2C(=O)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -16.934
InChIKey:RBOFETJAAOBFKI-UHFFFAOYSA-N
ID: 11880
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(O)(C)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.792
InChIKey:XIJZXVKTYPXYMR-UHFFFAOYSA-N
ID: 11881
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.502
InChIKey:RRTCKFILLWCXSO-UHFFFAOYSA-N
ID: 11882
SMILES:Cc1c(Oc2cc(CCCCC)cc3c2OC(C)(C)C(O)C3O)ccc2c1CCC(C(C)(C)O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -15.477
InChIKey:KKOKPUQMTRFZMH-UHFFFAOYSA-N
ID: 11883
SMILES:C1C(OC)C([CH])C2C(C)(C(O)C3C(c4c(cc(CCCCC)cc4OC)O3)O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.453
InChIKey:IHQVWOIDIDQACF-UHFFFAOYSA-N
ID: 11884
SMILES:C12C(C)=CC=C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -17.922
InChIKey:XYRXUPYKRNNNDE-UHFFFAOYSA-N
ID: 11885
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(O)C(O)C(C(C)C)CC2(C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.409
InChIKey:BDRAXOQLODYPLW-UHFFFAOYSA-N
ID: 11886
SMILES:C1C2C=C(C(C)(C)OC3Oc4c(c(O)c(C(=O)O)c(CCCCC)c4)C3=O)C(O)C2OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.496
CB1 binding score: -16.83
InChIKey:XSOKEXNLRXZFCM-UHFFFAOYSA-N