ID: 140911
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.898
InChIKey:SUVXTOCRTNYFMQ-UHFFFAOYSA-N
ID: 140912
SMILES:CCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.265
InChIKey:KTPDAZGMXXWSMU-UHFFFAOYSA-N
ID: 140913
SMILES:C(C)CC(C)=CCCC(=CCc1c(O)c(C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.418
InChIKey:BJHLOZBPLINYOB-UHFFFAOYSA-N
ID: 140914
SMILES:C12(C)Oc3cc(C)cc(O)c3C1CC(O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.321
CB1 binding score: -14.012
InChIKey:VTTFILIRMPTVDT-UHFFFAOYSA-N
ID: 140915
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.894
InChIKey:GGGXUYQLYROASS-UHFFFAOYSA-N
ID: 140916
SMILES:CC(C)(C(CC)C=CC(C)(C(C)(C)C)C)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -13.153
InChIKey:ZCJCQGPEBXFTGV-UHFFFAOYSA-N
ID: 140917
SMILES:OC(=O)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.078
InChIKey:XNMNHDKVZPBVMP-UHFFFAOYSA-N
ID: 140918
SMILES:CC(O)(C(O)C1(c2c(O)cc(CCCCC)cc2O)CC2=CCCC(C)(C)C2(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -14.651
InChIKey:LVTKAVOLWCCIFU-UHFFFAOYSA-N
ID: 140919
SMILES:O1c2c(C(C(CC)C)=O)c(O)cc(O)c2C2C13C(C)CCC(C3(C)C)CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -16.026
InChIKey:KFMXTEAQLDRQBZ-UHFFFAOYSA-N
ID: 140920
SMILES:c1(O)cc(CCCCC)cc2c1C1C(=C(C)CC3C=C(C)CCC(C(C)C)C13)OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -14.474
InChIKey:JKIGGKGXMMIVHJ-UHFFFAOYSA-N
ID: 140921
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(CC=C(C)C)OC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.502
InChIKey:DRAIXBFLNGZDEE-UHFFFAOYSA-N
ID: 140922
SMILES:C(=C(CCC(O)C(C)(C)OO)C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.498
CB1 binding score: -15.808
InChIKey:ALNFRSINOKSDFY-UHFFFAOYSA-N
ID: 140923
SMILES:Oc1cc(CC=C(CC(C=C(C)C)=O)C(O)=O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.878
InChIKey:IYHYLHFEDKIDBR-UHFFFAOYSA-N
ID: 140924
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -19.22
InChIKey:AHKIGVNVQSVNEP-UHFFFAOYSA-N
ID: 140925
SMILES:c1(CCCCC)c(C(=O)O)c2c(c(O)c1C)OC(C)(C)C1CCC(C=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.766
InChIKey:PMHYECDIKFIVLL-UHFFFAOYSA-N
ID: 140926
SMILES:C12C(CCC(C)=C1)C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.951
InChIKey:CSAQQDLBKSCGOR-UHFFFAOYSA-N
ID: 140927
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 140928
SMILES:C12OC(=O)C(C)=C1CC1CCC3(C)Oc4cc(CCCCC)cc(O)c4C3CC(C)=CCCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -15.41
InChIKey:DKXOYUQEFURNQU-UHFFFAOYSA-N
ID: 140929
SMILES:c12c(OC3OC(CO)C(O)C3O)cc(CCCCC)cc1OC1(C)C=CC(C(C)C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.583
CB1 binding score: -13.9
InChIKey:ARBYRGYYLSOMGB-UHFFFAOYSA-N
ID: 140930
SMILES:C1C(C)=CC(c2ccc(C=O)cc2OC)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -18.625
InChIKey:GYIHBOAOMZBFAW-UHFFFAOYSA-N
ID: 140931
SMILES:C(C1CCC(C)=CC1c1c(O)cc(C(CCCCC)C)cc1O)(C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -15.656
InChIKey:DLQDMDSFXKAYAR-UHFFFAOYSA-N