ID: 88873
SMILES:OC1C(O)C(O)C(CO)OC1OCC1(O)CC23c4c(cc(CCCCC)cc4O)OC(C)(C)C2CCC2(C)OC23C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.699
CB1 binding score: -11.653
InChIKey:DPLVRPXZSHTEBP-UHFFFAOYSA-N
ID: 88874
SMILES:C1C2C(O)C(C1)C(C)(C)Oc1c2c(O)c(C=O)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.588
InChIKey:TZULQUHWWFWNHE-UHFFFAOYSA-N
ID: 88875
SMILES:C(CCc1cc(O)c(C2C(C(C)=C)CC(O)C(C)=C2)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.379
InChIKey:RMHCLTYYQYGFLJ-UHFFFAOYSA-N
ID: 88876
SMILES:CC(CCc1c(O)c(CC=C(C)CCC=C(C)C)cc(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.908
InChIKey:DSSSQDRTFPIHKY-UHFFFAOYSA-N
ID: 88877
SMILES:c1(C)c(C(CC(OCC)=O)OC(C)=O)cc(OC(=O)C)c2c1OC1(C)CC2C(C(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.566
CB1 binding score: -15.374
InChIKey:MGYNNDDGVJDYNP-UHFFFAOYSA-N
ID: 88878
SMILES:C1CC(C)(C)C2CC(=O)C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.394
InChIKey:NRBNICRNBWOUIS-UHFFFAOYSA-N
ID: 88879
SMILES:C(CCCC(C)(Oc1c2c(cc(C(O)=O)c1)OC(C)(C)C1CC=C(C)C(=O)C21)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.232
InChIKey:IOGDFGPGSMVCOB-UHFFFAOYSA-N
ID: 88880
SMILES:CC1(C)Oc2cc(CCCCC)c(O)c(O)c2C2C(CC=C(C)CCC=C(C)C)(C1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -13.996
InChIKey:LZZCASGYMUWWGQ-UHFFFAOYSA-N
ID: 88881
SMILES:C12C(C(C)(C)Oc3c1ccc(C(O)=O)c3)C=CC(C)=CCC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -12.392
InChIKey:AEYLPKYDOKLWJS-UHFFFAOYSA-N
ID: 88882
SMILES:C(Cc1c(OC)cc(CCCCC)cc1O)=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 88883
SMILES:C1(C(C)C)CC(c2c(O)cc(CCCCC)cc2O)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.877
InChIKey:VVWFCDARSXHIGS-UHFFFAOYSA-N
ID: 88884
SMILES:O1c2c(cc(OC)c(C3C=C(C)C(O)CC3C(C)=C)c2)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -12.127
InChIKey:QDQQRWOKBJZRHK-UHFFFAOYSA-N
ID: 88885
SMILES:C12C(C)(CCC(=O)C1(C)CO)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.315
InChIKey:XWBJVYOSOYEQIP-UHFFFAOYSA-N
ID: 88886
SMILES:C(CCC)Cc1cc2c(c(O)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 88887
SMILES:c1(CCCCC)c(O)c2c(c(C=O)c1O)OC1(C)C3C2C(C(C)(C)O)CCC3(C)C(Br)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 523.508
CB1 binding score: -15.201
InChIKey:RULFZROFZDQGNI-UHFFFAOYSA-N
ID: 88888
SMILES:Oc1c(CCCCC)cc(O)c2c1OC(C)(C)C1CC=C(C)C(=O)C1=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.56
InChIKey:BJRJOELYEPNPQG-UHFFFAOYSA-N
ID: 88889
SMILES:C12=C(c3c(O)cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.221
InChIKey:RDIYZGFRMMDIHA-UHFFFAOYSA-N
ID: 88890
SMILES:OC1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C1C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -17.183
InChIKey:AREGKQBLOXHIRP-UHFFFAOYSA-N
ID: 88891
SMILES:CC(=CC)C(OCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.007
InChIKey:DETKUCUPVXXMKP-UHFFFAOYSA-N
ID: 88892
SMILES:C1C(CCCC(C)C)(C)Oc2cc(C)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.215
InChIKey:BYDWXXJPLPOGRW-UHFFFAOYSA-N
ID: 88893
SMILES:C(c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N