ID: 125959
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1CC(=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 125960
SMILES:c12c(CCCCC)cc(OC)cc1OC(C)(C)C1CCC(=C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.449
InChIKey:GIWBNNBALAGWCA-UHFFFAOYSA-N
ID: 125961
SMILES:CC1(C)C2CCC(C)=CC2c2c(C)cc(O)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.409
InChIKey:BJMZVRMKKMPCLN-UHFFFAOYSA-N
ID: 125962
SMILES:c1(CCc2ccccc2OC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 378.512
CB1 binding score: -14.721
InChIKey:XMBMWLKJNCGHTJ-UHFFFAOYSA-N
ID: 125963
SMILES:OCC1C(O)C(O)C(O)C(OCC2(C)C3CCC(C)=CC3c3c(cc(C)cc3O)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.501
CB1 binding score: -13.842
InChIKey:DOARVNZGAKQYFV-UHFFFAOYSA-N
ID: 125964
SMILES:Oc1c(CC=C(CCC=C(C)CCC=C(C)C)C)c(O)cc(CCCCC[N+](C)(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.708
CB1 binding score: -17.522
InChIKey:DYPRHNYXSCGEMU-UHFFFAOYSA-O
ID: 125965
SMILES:C12C(C(C)(C)O)CCC(C)(Oc3cc(CCCCCC)cc(O)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.627
InChIKey:WKVIRZJNKJVJOP-UHFFFAOYSA-N
ID: 125966
SMILES:c1c(C(C)C)c(O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.792
InChIKey:XJNQCCLSLVYFNV-UHFFFAOYSA-N
ID: 125967
SMILES:C(C(C1=CC(=O)C(C)(C)O1)C)CCC(C)=CCCC1(C)Oc2c(C)cc(O)cc2C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.929
InChIKey:GNUDDSQPCRUHON-UHFFFAOYSA-N
ID: 125968
SMILES:COc1cc(C)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.99
InChIKey:JIAMDLHQCKSETM-UHFFFAOYSA-N
ID: 125969
SMILES:C(CCC)Cc1cc2c(c(O)c1)C(=O)C1C(C)(CCC=C(C)C)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.288
InChIKey:INFNSAUKZKVSMP-UHFFFAOYSA-N
ID: 125970
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 125971
SMILES:O(C)c1c(OC)cc(C)cc1-c1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -13.522
InChIKey:SDIHRDZGVUYACY-UHFFFAOYSA-N
ID: 125972
SMILES:Oc1c(CC=C(CCC(C(O)(CCC=C(C)C)C)O)C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -15.948
InChIKey:RTCPSTMHYPCXBU-UHFFFAOYSA-N
ID: 125973
SMILES:c1(O)c(C2C3C(O)(C)CCC(C(C)C)C3C=C(C)C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 400.603
CB1 binding score: -14.107
InChIKey:NHOQUCWDWJXSMP-UHFFFAOYSA-N
ID: 125974
SMILES:C1CCC(C)(C)C2C1(C)Oc1cc3c(c(O)c12)cc(CCCCC)cc3O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.592
InChIKey:BGXPNSFGRQGYBV-UHFFFAOYSA-N
ID: 125975
SMILES:C1(C)CC(C(C)=C)C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.015
InChIKey:ULPZKHYVDDCXQO-UHFFFAOYSA-N
ID: 125976
SMILES:CC(OC)(C)C1CCC2(C)Oc3cc(CCCCC)cc(O)c3CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.866
InChIKey:NEUKLOYPGWCFRF-UHFFFAOYSA-N
ID: 125977
SMILES:C(Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.691
InChIKey:ZBBXHJRPBQMOEE-UHFFFAOYSA-N
ID: 125978
SMILES:CC1(C)Oc2cc(O)cc(CCCCC)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.388
InChIKey:MSBZVKLTPVIGLC-UHFFFAOYSA-N
ID: 125979
SMILES:C(=CC(=O)CCCCc1cc(O)c(C2CC(=O)C(C)=CC2c2cc(O)cc(C)c2OC2(C)CCCC(C)(C)O2)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.757
CB1 binding score: -14.605
InChIKey:WCYRXCKDXZZTPF-UHFFFAOYSA-N