ID: 57667
SMILES:c1(CCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 57668
SMILES:O(CC=C(C)C)C(=O)C1C=C(C)CC(c2c(O)ccc(CC(=C)C=CCC(C)C)c2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.391
InChIKey:ZXHQJOIDXHTIFW-UHFFFAOYSA-N
ID: 57669
SMILES:C1c2c(cc(CCCCC=O)cc2O)C=C(C)CCC(C(=C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.017
InChIKey:XCGZURLXEVTPEF-UHFFFAOYSA-N
ID: 57670
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(=C)C)CC(C)(CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.742
InChIKey:FQXHQOYLNLLFEC-UHFFFAOYSA-N
ID: 57671
SMILES:COc1cc(OC)c(Cl)c2c1C(=O)C13CC(C(C)(C)O1)C(C)(C)C3OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.922
CB1 binding score: -14.947
InChIKey:AIRKHXDBXZZPGZ-UHFFFAOYSA-N
ID: 57672
SMILES:c1(C(C)C)c(O)c(C(C(C)C)O)c(O)c2c1OC(C)(C)C1CCC(C(OC)=O)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -17.554
InChIKey:UVJOTBCWMNPWTG-UHFFFAOYSA-N
ID: 57673
SMILES:CC(=CCC12c3c(cc(CCC)cc3O)OC(C)(C)C3C1(O2)CC(C)C(Oc1cc(CC=C(C)CCC=C(C)C)cc(O)c1)O3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 630.866
CB1 binding score: -16.277
InChIKey:LSTSTZBKMSSRQA-UHFFFAOYSA-N
ID: 57674
SMILES:OC(C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)C(O)C1)C)OCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.59
CB1 binding score: -12.354
InChIKey:MUZMOOPPUWANCX-UHFFFAOYSA-N
ID: 57675
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(CO)=CCC1(C)CCC2C(C)C)CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -14.727
InChIKey:CXXDSSBFZDPFTA-UHFFFAOYSA-N
ID: 57676
SMILES:c1c(CC[N+](C)(C)C)ccc(C2C=C(C)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.494
CB1 binding score: -12.301
InChIKey:HKBFRAHBWCMJAU-UHFFFAOYSA-N
ID: 57677
SMILES:C(C=C(CCC=C(CCC=C(C)C)C)C)c1c(O)c(C(=O)O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 57678
SMILES:c1(CCCC)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 57679
SMILES:c1(C(O)C(C)C)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.013
InChIKey:FGFOTVXVDVGRKF-UHFFFAOYSA-N
ID: 57680
SMILES:C(c1ccc(CO)c(C2C(C(C)=C)CCC(C)=C2)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -14.936
InChIKey:HDQPZPIHAGRTQD-UHFFFAOYSA-N
ID: 57681
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 57682
SMILES:C(CCCc1cc(O)c2c(c1O)C1C=C(C(O)=O)CCC1C(C)(C)O2)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -17.387
InChIKey:QIOSFAXYDRMZEZ-UHFFFAOYSA-N
ID: 57683
SMILES:C12CCC(C)C3(O)C(c4c(cc(CCCCC)cc4O)O3)C1OC(O)C2(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -14.014
InChIKey:LTJGBPFSMVTXAZ-UHFFFAOYSA-N
ID: 57684
SMILES:C(=CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C=C1)(C)C=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -13.081
InChIKey:ZMFHSFDXMQQIOF-UHFFFAOYSA-N
ID: 57685
SMILES:CC12CCCC(C)(C)C1=Cc1c(cc3c(c1O)-c1c(ccc(C)c1)C(C)(C)O3)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.604
CB1 binding score: -13.522
InChIKey:ADNJWHDKUYNRKY-UHFFFAOYSA-N
ID: 57686
SMILES:C12(O)C(O)=C(C)C(=O)C(OC)C1C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -12.012
InChIKey:WFSILOJYUSHVAM-UHFFFAOYSA-N
ID: 57687
SMILES:c1c(O)c2c(cc1CCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N