ID: 98806
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(=C)C)CC=C(C=O)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -15.072
InChIKey:TXPKSZJCWOIRGM-UHFFFAOYSA-N
ID: 98807
SMILES:c12c(cc(CCCCC)cc1O)OC(CCC=C(C)CCC=C(C)C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.558
InChIKey:MKQIIHJRLOINRL-UHFFFAOYSA-N
ID: 98808
SMILES:C(CC=C(C)C)C(=CCCC1(C)Oc2c(O)c(O)cc(CCCCCC)c2C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.89
InChIKey:QROLDHBBEIIBON-UHFFFAOYSA-N
ID: 98809
SMILES:c1(O)cc(CCCC)cc2c1OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.346
InChIKey:ZAQQWBAGWYVVIJ-UHFFFAOYSA-N
ID: 98810
SMILES:C1CC(C)C2C(c3c(O)cc(CC)cc3O2)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.039
InChIKey:DDYQNOURVWBVAF-UHFFFAOYSA-N
ID: 98811
SMILES:C1CC(C(C)=C)C(c2c(OC(=O)C)cc(CCCCC)cc2OC(=O)CCCCCCC)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -14.651
InChIKey:AKIOMUBVVVNIGD-UHFFFAOYSA-N
ID: 98812
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1=C(C(=O)OCC)C3C(CC1C(=C)C)C(C)(C)OC3CC(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.743
CB1 binding score: -14.272
InChIKey:ILVVUMNEILWNLW-UHFFFAOYSA-N
ID: 98813
SMILES:C12C(CC(C(C)(C)OC3OCCC4C3(C)CCC=C4)Oc3c1c(O)cc(CCCCC)c3)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -13.946
InChIKey:NITVXEYCHWBKDY-UHFFFAOYSA-N
ID: 98814
SMILES:C1(C)(C)Oc2cc(C)c3c(c2CC(=Cc2ccccc2)O)CC(CCCCC)C(C)C3C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -15.67
InChIKey:NIKOCYFUDYSVGV-UHFFFAOYSA-N
ID: 98815
SMILES:C1=C(CO)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 98816
SMILES:O(c1c(C)c(O)c(O)c2c1OC(C)(C)C1CC=C(C)C1CC2=O)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -14.716
InChIKey:CCMVTKBJZYUATA-UHFFFAOYSA-N
ID: 98817
SMILES:CC(C)=CCCC(=CCc1c(O)c(C(=O)OC)c(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -16.349
InChIKey:NQHPCKANHGPLFT-UHFFFAOYSA-N
ID: 98818
SMILES:C1(CC=CC(C)=C)(C)CC=C(C)CC1c1cc(CCCCC)cc(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.57
InChIKey:XMRZLYQUSHCKAA-UHFFFAOYSA-N
ID: 98819
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 98820
SMILES:Oc1c(C=O)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 98821
SMILES:c12c(c(O)cc(CCCCC)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 98822
SMILES:C1(Oc2c3c(cc(CCCCC)c2)OC(C)(C)C2C3C2)OC(C)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.114
InChIKey:GTOJGDXBXAXRLX-UHFFFAOYSA-N
ID: 98823
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 98824
SMILES:O=C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2CC(C)CC1)NC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 371.521
CB1 binding score: -15.841
InChIKey:JMDAJIKCOBYSGO-UHFFFAOYSA-N
ID: 98825
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(OC(C)=O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.735
InChIKey:IBTXDRGQLGXUGK-UHFFFAOYSA-N
ID: 98826
SMILES:C(CCC)Cc1cc(O)c(C2OC(O)C(CCC=C(C)C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.171
InChIKey:SZIHGBALCNAVPE-UHFFFAOYSA-N