ID: 26776
SMILES:Oc1c(C)cc2c(c1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 26777
SMILES:C(C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.904
InChIKey:NLKJBARTFVEECE-UHFFFAOYSA-N
ID: 26778
SMILES:C1CC(C(C)(C)O)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -15.612
InChIKey:XJNWDKMPVZGNIV-UHFFFAOYSA-N
ID: 26779
SMILES:CC1(C)Oc2cc(O)c(C(=O)C(CC)C)c(O)c2C2CC1CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.027
InChIKey:YUPSRGQELMUYEJ-UHFFFAOYSA-N
ID: 26780
SMILES:CN(Cc1c(O)cc(CCCCC)cc1OC)C
Pathway: Alkaloids;Polyketides
Superclass: Tyrosine alkaloids;Meroterpenoids
Class: Cannabinoids;Phenylethylamines
MW: 251.37
CB1 binding score: -17.821
InChIKey:WLVZWBUUCRLTGW-UHFFFAOYSA-N
ID: 26781
SMILES:CC(C1(C)C2CCC(C(O)=O)=CC2c2c(O)cc(CCCCC)cc21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.822
InChIKey:HYPJGGQPRUMJGB-UHFFFAOYSA-N
ID: 26782
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 26783
SMILES:c12cc(CCCCC)cc(O)c1CC(C(C)=C)CCC1=CCCC(C)(C)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -16.815
InChIKey:FPFGGEIQOIETAN-UHFFFAOYSA-N
ID: 26784
SMILES:C1C(C(C)=C)C(c2c(O)c(OC)c(CCCCC)cc2OC)C=C(CO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.829
InChIKey:SYTVUDHSQHYLSD-UHFFFAOYSA-N
ID: 26785
SMILES:c1(O)cc(CO)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.098
InChIKey:FUBDUJLSPGGJKP-UHFFFAOYSA-N
ID: 26786
SMILES:c1(C)c(C(C)=O)c(=O)c2c(cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.239
InChIKey:VLVBCYODUFVLEE-UHFFFAOYSA-N
ID: 26787
SMILES:C=C(C)C1C(c2c(O)cc(CCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.738
InChIKey:GGQDIFOIULQGMW-UHFFFAOYSA-N
ID: 26788
SMILES:C(C1CCc2c(cc(CCCCC)cc2O)O1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -14.605
InChIKey:RJYORERXLQKFIT-UHFFFAOYSA-N
ID: 26789
SMILES:C12Oc3c(cc(CCCCC)cc3O)C(C1(C)C)CCC(C)=CCCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.857
InChIKey:LTFFVFDITCLTAK-UHFFFAOYSA-N
ID: 26790
SMILES:C12(CC1)C(C)(O)CC1C(Oc3c(cc(CCCCC)cc3OC)O1)C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.925
InChIKey:OSSSFKXQSIRXRZ-UHFFFAOYSA-N
ID: 26791
SMILES:O1c2c(c(O)cc(CCCC)c2)C2C(C(C)(O)C)C(OC2=O)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -17.14
InChIKey:WWCYAYKQBRWBDJ-UHFFFAOYSA-N
ID: 26792
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 26793
SMILES:C1(C(C)=C)C(c2cc(CCN(C)C)ccc2OC)C=C(C(=O)OC)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.494
CB1 binding score: -11.964
InChIKey:WXRQGOTZGFTJHN-UHFFFAOYSA-N
ID: 26794
SMILES:C(CC)Cc1cc2c(c(O)c1)C1C(C(C)C)OOC2(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.411
InChIKey:GHOHMHMKHUDDNY-UHFFFAOYSA-N
ID: 26795
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.402
InChIKey:USZILQYXSONCHH-UHFFFAOYSA-N
ID: 26796
SMILES:C=Cc1c2c(c(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.303
InChIKey:GEDQPSVBEMIWDS-UHFFFAOYSA-N