ID: 92779
SMILES:C(CCC(CCC=C(C)C)C)C(=CCc1c(O)c(C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.162
InChIKey:GVVUQQWWMGBFAL-UHFFFAOYSA-N
ID: 92780
SMILES:C(CCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 92781
SMILES:C1(C)(C)C2CCC(O)C=C2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.117
InChIKey:FWGZBVKKWKSPNV-UHFFFAOYSA-N
ID: 92782
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 92783
SMILES:O=Cc1c(O)c(C(OCCC)=O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -14.304
InChIKey:WGZNKSNCOGAQIY-UHFFFAOYSA-N
ID: 92784
SMILES:C(CCC)CCc1cc(O)c(CC=C(CCC=C(C)C)C(=O)O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.602
InChIKey:HVOFTYCIOKLYNQ-UHFFFAOYSA-N
ID: 92785
SMILES:C(C)(=CCc1c(OC)c(CCCCC)cc(O)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.939
InChIKey:LOXIJZODUCQESR-UHFFFAOYSA-N
ID: 92786
SMILES:C1(C(C)(O)C)CC=C(C)CC1c1c(O)cc(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.177
InChIKey:CIAXKIJLIZPEKU-UHFFFAOYSA-N
ID: 92787
SMILES:O1c2c(c(O)cc(CCCC)c2)C2=CCC(O)C(C)(CCC3C(C)(C)C3)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.71
InChIKey:DOBAFEFHWGVWQI-UHFFFAOYSA-N
ID: 92788
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1C=C(C)C(=CC=CC=CC(C)=CC(C(OC)=O)C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -15.905
InChIKey:QJQSOFJQDDYQCV-UHFFFAOYSA-N
ID: 92789
SMILES:C(CCC)c1cc2c(c(O)c1)C1C(C(C)(C=C)CCC1C(C)=C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.117
InChIKey:ZUDCMMAQTGKVRX-UHFFFAOYSA-N
ID: 92790
SMILES:CC1(C)C2CCC(C=O)=CC2c2c(cc(C)c(C(O)=O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -14.694
InChIKey:RGNUSGDURUOULQ-UHFFFAOYSA-N
ID: 92791
SMILES:C1(C)(C)c2c(cc(C)c(O)c2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 92792
SMILES:C1C(O)(C)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.522
InChIKey:XTHXQACBFDXOKH-UHFFFAOYSA-N
ID: 92793
SMILES:C1=C(C)C(CCCC)C(C)(CCC(C(O)(C)C)O)Oc2ccccc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.67
InChIKey:UOSCZOVMMZBLDP-UHFFFAOYSA-N
ID: 92794
SMILES:C(c1cc(CC=C(CCC=C(C)C)C)c(-c2ccc(O)cc2CCCCC)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 434.664
CB1 binding score: -14.113
InChIKey:CVJUXSPWZMKRQD-UHFFFAOYSA-N
ID: 92795
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 92796
SMILES:C1C(C(C)C)C(O)C2C(C)(C1)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.506
InChIKey:FVIBLWDPAODAHM-UHFFFAOYSA-N
ID: 92797
SMILES:O(C(C1(c2c(OC(C)=O)cc(CCCCC)cc2O)CC(C)CC1)C=CC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.98
InChIKey:KPUWGOPGSLLMCA-UHFFFAOYSA-N
ID: 92798
SMILES:C(C=C(C)C)CC(C)=CCCC1(C)Oc2c(c(O)c(C(=O)O)c(CCCCC)c2)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -17.332
InChIKey:KHPGMUANVIFMOU-UHFFFAOYSA-N
ID: 92799
SMILES:C1C2c3c(cc(CCC(=O)C=CCCC)cc3O)OC(C)(C)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.757
InChIKey:DSTBAZAKKLHXLQ-UHFFFAOYSA-N