ID: 13819
SMILES:CC1(CCC(=O)O)Oc2c(c(O)cc(C)c2)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.321
CB1 binding score: -15.629
InChIKey:IQIZSZAIOXUNDF-UHFFFAOYSA-N
ID: 13820
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 13821
SMILES:C1Cc2c(cc(O)c(O)c2)C(C)(C)C2c3cc(OC4OC(CO)C(O)C(O)C4O)cc(CCCCC)c3OC(C)(C)C3CC123
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 612.76
CB1 binding score: -18.293
InChIKey:RVSLFPNHROLVGJ-UHFFFAOYSA-N
ID: 13822
SMILES:CC1(C)C2(O)C(CC(C)=CC2)c2c(cc(CCCCCO)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.522
InChIKey:FIHZBHRMAOEKLY-UHFFFAOYSA-N
ID: 13823
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(O)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.07
InChIKey:DNXULHNDEXCFPN-UHFFFAOYSA-N
ID: 13824
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 13825
SMILES:c1c(C2=COC(C)(C)C3C2C=C(C)CCC3C(C)=C)cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.465
CB1 binding score: -12.886
InChIKey:PKWGIZYEFTVSJB-UHFFFAOYSA-N
ID: 13826
SMILES:O(CCCC)c1cc(C=O)c(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.971
InChIKey:RFHRUXVWFXBISF-UHFFFAOYSA-N
ID: 13827
SMILES:C(C1Oc2cc(CCCCC)cc(O)c2C2C=C(C(O)=O)CCC21C(C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -11.938
InChIKey:DNLOBYZNPCHUOF-UHFFFAOYSA-N
ID: 13828
SMILES:C1(C)(C)CC2C3(Oc4c(C(O)=O)c(CCCCC)cc(O)c43)C3C(=O)C(C2C1C)C3C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.724
InChIKey:PZPXRBDVFPFFHT-UHFFFAOYSA-N
ID: 13829
SMILES:C1CC2C3(C(C1C)OOC3)Oc1c(c(O)cc(CCCCC)c1)C2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.127
InChIKey:QDCGAUMJWXKCJG-UHFFFAOYSA-N
ID: 13830
SMILES:C1C=C(C)C(CCC(C)=CCCC2(C)C=Cc3c(c(C)cc(O)c3)O2)(C)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.783
InChIKey:UXKLYCGWCKPSNU-UHFFFAOYSA-N
ID: 13831
SMILES:CC(C)CC1C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.393
InChIKey:SFZHTOAJPKFWLV-UHFFFAOYSA-N
ID: 13832
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)(O)C1CCC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -17.388
InChIKey:PYJVGACCMQHTRE-UHFFFAOYSA-N
ID: 13833
SMILES:C(C1C(C)(C)Oc2c1c(O)cc(CCCCC)c2)=CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.88
InChIKey:OFRIDUMGWABNQT-UHFFFAOYSA-N
ID: 13834
SMILES:c1c2c(cc(CCCCC)c1)OC(CO)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.439
InChIKey:FARXJZJFLXGEGJ-UHFFFAOYSA-N
ID: 13835
SMILES:Oc1c2c(cc(C)c1[O-])C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 273.352
CB1 binding score: -10.139
InChIKey:XWMNHGVOSIHLHJ-UHFFFAOYSA-M
ID: 13836
SMILES:C1C(C)(C)OC(C)=C(Cc2cc(O)cc(C)c2OC)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -15.929
InChIKey:WRTYBUKECUJLEF-UHFFFAOYSA-N
ID: 13837
SMILES:C(C)CCCCCCCCCc1cc2c(c(O)c1)C1C=C(C(=O)O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.239
InChIKey:KNHROPICDBQRQV-UHFFFAOYSA-N
ID: 13838
SMILES:C12(C)CCC(C(C)=C)C(c3c(O)cc(CCCCC)cc3O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 13839
SMILES:C12C(C(=O)C=C(C)C1)C(C)(C)Oc1c2ccc(C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -16.502
InChIKey:PDVKRTIFDYZSPF-UHFFFAOYSA-N