ID: 127786
SMILES:C(Cc1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.936
InChIKey:TZFPIQSSTVIJTQ-UHFFFAOYSA-N
ID: 127787
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(C(C)=C)CCC(C)=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.644
InChIKey:IEERHDNDIMSELQ-UHFFFAOYSA-N
ID: 127788
SMILES:c1(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.857
InChIKey:ADVBWFBGNLNRPY-UHFFFAOYSA-N
ID: 127789
SMILES:C(C)(=CCc1c(O)cc(CCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 127790
SMILES:O(c1c(C2C(C(=C)C)CCC(C)=C2)c(O)c(C(=O)CC(C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -18.441
InChIKey:XAWXEHLSGZRRRH-UHFFFAOYSA-N
ID: 127791
SMILES:CC1(C)Oc2cc(O)cc(C)c2C(=O)C2C(C)=CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -15.173
InChIKey:RMQFQBYIUXFRAT-UHFFFAOYSA-N
ID: 127792
SMILES:C12OC13CC(OC(C)=O)C1=C(O3)CCC(C(C)=C)C1c1c(O)cc(C)cc1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.428
CB1 binding score: -12.593
InChIKey:SUMNFVDSOVRUMT-UHFFFAOYSA-N
ID: 127793
SMILES:C(C1(C)C(O)Cc2c(O)cc3c(c2O1)CC1C3CC(C)(C)OO1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -13.464
InChIKey:QPAOMVUXYSWNRY-UHFFFAOYSA-N
ID: 127794
SMILES:C(C1=C(C2C(C(=C)C)CCC(C)=C2)c2c(O)cc(CCC)cc2O1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.494
InChIKey:DGUBZWDDBNXYLM-UHFFFAOYSA-N
ID: 127795
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.442
InChIKey:FRBSLGKYEBNHLH-UHFFFAOYSA-N
ID: 127796
SMILES:Brc1ccc2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 307.231
CB1 binding score: -18.101
InChIKey:NUFAWTFHHNIXAW-UHFFFAOYSA-N
ID: 127797
SMILES:C12(C)C(O)CC(C(C)=C)C1Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.122
InChIKey:JPKHVIJOMCNFRP-UHFFFAOYSA-N
ID: 127798
SMILES:C(CCC(C)=CCCC1=CCC(c2cc(OC)cc(C)c2O)CN1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 369.549
CB1 binding score: -15.62
InChIKey:WAHKOHGEHXKQQI-UHFFFAOYSA-N
ID: 127799
SMILES:C1(C)(C)C2CC(=O)C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.046
InChIKey:UECUNLJHUBNWSC-UHFFFAOYSA-N
ID: 127800
SMILES:C(OC(=O)C=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.043
InChIKey:GVVSQAFZXFRLES-UHFFFAOYSA-N
ID: 127801
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 127802
SMILES:C(c1cc(O)c(C2(C)CCC(C(=C)C)O2)c(O)c1)CC(C)=CCc1c(O)c(Br)c(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 517.46
CB1 binding score: -14.65
InChIKey:YWBPDENVAFKIIB-UHFFFAOYSA-N
ID: 127803
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)Cc1c2c(C)cccc2cc(C(C)(C)C=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.719
CB1 binding score: -13.581
InChIKey:VQYMWEKOGXAIMP-UHFFFAOYSA-N
ID: 127804
SMILES:c1(O)c(C(=O)CCC=C(C)C)c(OC(=O)C)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.331
InChIKey:VMCCPFYHCPLWNW-UHFFFAOYSA-N
ID: 127805
SMILES:C1C(CO)=CC(c2cc(CCCCC)cc(O)c2)C(C(C)(O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.355
InChIKey:QJQKXDGSMYAFKP-UHFFFAOYSA-N
ID: 127806
SMILES:CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N