ID: 88705
SMILES:CC(=O)C1CC2C(C)(C)Oc3c(c(O)c(C=O)c(C)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.792
InChIKey:CFEUSZKBWWZRCO-UHFFFAOYSA-N
ID: 88706
SMILES:C1(C)(C)C(=O)C2=C(CC3C(C)(C)Oc4cc(CCCCC)c(C(=O)O)c(O)c4C32O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -17.089
InChIKey:CCLPLRAMVACCPC-UHFFFAOYSA-N
ID: 88707
SMILES:C(CC1=CC(=O)C2=C(C1=O)OC1(C)C(C2)C(C(=C)C)CC1)CC(C(=O)O)(C)OC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -17.834
InChIKey:SITIXZHQXMDGEQ-UHFFFAOYSA-N
ID: 88708
SMILES:C1CC2C(C)(C)Oc3c(c(OC(CCCCC)=O)cc(C)c3)C2C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.998
InChIKey:NUOHSMDQMCOSDP-UHFFFAOYSA-N
ID: 88709
SMILES:c12c(OC)cc(CC=C)cc1OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -16.502
InChIKey:LTCBVUJOZAPBQL-UHFFFAOYSA-N
ID: 88710
SMILES:C1(C)(C)C2C(=O)C=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N
ID: 88711
SMILES:C(C=CC)Cc1c(O)cc2cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -13.805
InChIKey:LGGPFLRPNCBSKG-UHFFFAOYSA-N
ID: 88712
SMILES:C(CC=C(C)C)C1(C)Oc2c(c(O)cc(CCOC)c2)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.085
InChIKey:KBDQEILOUXUWRI-UHFFFAOYSA-N
ID: 88713
SMILES:C(C(C)=CC(=O)c1c(O)cc(CCCCC)cc1O)=CC(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -13.736
InChIKey:GIMZPQFITZBWPV-UHFFFAOYSA-N
ID: 88714
SMILES:c1(C)cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.006
InChIKey:SUFPQJMELBBUPW-UHFFFAOYSA-N
ID: 88715
SMILES:C(CC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2C1CCC(C)=C2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.515
InChIKey:IKOUQZGTMCOQSL-UHFFFAOYSA-N
ID: 88716
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C(=O)O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 88717
SMILES:C(C1C2C(CC1O)c1c(cc(CCCCC)cc1OC)OC2(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.875
InChIKey:XOONPADESZLBIN-UHFFFAOYSA-N
ID: 88718
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 88719
SMILES:C(=Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1O)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.407
InChIKey:QSCCALONLREBCN-UHFFFAOYSA-N
ID: 88720
SMILES:C1(C(C)C)=CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C3OC32C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.438
InChIKey:RPAVNHQQZUVUQU-UHFFFAOYSA-N
ID: 88721
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(O)C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.62
InChIKey:LLKUIEBBEPXRRI-UHFFFAOYSA-N
ID: 88722
SMILES:C1(=O)CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.087
InChIKey:XPVRCIKHRUNSLR-UHFFFAOYSA-N
ID: 88723
SMILES:C12C(OC(=O)C)CC(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -18.452
InChIKey:OTVZLNJTTWRQJW-UHFFFAOYSA-N
ID: 88724
SMILES:CC1(C)C2CC3(c4c(cc(CCCCC)cc4O)OC23CO)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.929
InChIKey:UFGQABBBOOFNRA-UHFFFAOYSA-N
ID: 88725
SMILES:c1(O)c(C(=O)C(C)C)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N